N-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine

C124H160B4N4 — CID 159683314

IUPACN-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine
SMILESC=CCC1C=C(B(C2C=C(CCCCCC)c3ccccc32)N(C(C)C)C(C)C)c2ccccc21.C=CCC1C=C(B(C2C=Cc3ccccc32)N(C(C)C)C(C)C)c2ccccc21.C=CCCCC1C=C(B(C2C=C(CCCCCC)c3ccccc32)N(C(C)C)C(C)C)c2ccccc21.C=CCCCC1C=C(B(C2C=Cc3ccccc32)N(C(C)C)C(C)C)c2ccccc21
InChIInChI=1S/C35H48BN.C33H44BN.C29H36BN.C27H32BN/c1-7-9-11-13-19-29-25-35(33-23-17-15-21-31(29)33)36(37(26(3)4)27(5)6)34-24-28(18-12-10-8-2)30-20-14-16-22-32(30)34;1-7-9-10-11-17-27-23-33(31-21-15-13-19-29(27)31)34(35(24(3)4)25(5)6)32-22-26(16-8-2)28-18-12-14-20-30(28)32;1-6-7-8-14-24-20-29(27-17-12-11-15-25(24)27)30(31(21(2)3)22(4)5)28-19-18-23-13-9-10-16-26(23)28;1-6-11-22-18-27(25-15-10-9-13-23(22)25)28(29(19(2)3)20(4)5)26-17-16-21-12-7-8-14-24(21)26/h8,14-17,20-28,35H,2,7,9-13,18-19H2,1,3-6H3;8,12-15,18-26,33H,2,7,9-11,16-17H2,1,3-6H3;6,9-13,15-22,24,28H,1,7-8,14H2,2-5H3;6-10,12-20,22,26H,1,11H2,2-5H3
InChIKeyMVLYFZPZQRFQSM-UHFFFAOYSA-N
MW1749.92 g/mol
LogP33.21
Rot. Bonds42

About N-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine

N-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine (PubChem CID 159683314) has the molecular formula C124H160B4N4 and a molecular weight of 1749.92 g/mol. Its IUPAC name is N-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine
PubChem CID159683314
Molecular FormulaC124H160B4N4
Molecular Weight1749.92 g/mol
Exact Mass1749.30
IUPAC NameN-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine
SMILESC=CCC1C=C(B(C2C=C(CCCCCC)c3ccccc32)N(C(C)C)C(C)C)c2ccccc21.C=CCC1C=C(B(C2C=Cc3ccccc32)N(C(C)C)C(C)C)c2ccccc21.C=CCCCC1C=C(B(C2C=C(CCCCCC)c3ccccc32)N(C(C)C)C(C)C)c2ccccc21.C=CCCCC1C=C(B(C2C=Cc3ccccc32)N(C(C)C)C(C)C)c2ccccc21
InChIInChI=1S/C35H48BN.C33H44BN.C29H36BN.C27H32BN/c1-7-9-11-13-19-29-25-35(33-23-17-15-21-31(29)33)36(37(26(3)4)27(5)6)34-24-28(18-12-10-8-2)30-20-14-16-22-32(30)34;1-7-9-10-11-17-27-23-33(31-21-15-13-19-29(27)31)34(35(24(3)4)25(5)6)32-22-26(16-8-2)28-18-12-14-20-30(28)32;1-6-7-8-14-24-20-29(27-17-12-11-15-25(24)27)30(31(21(2)3)22(4)5)28-19-18-23-13-9-10-16-26(23)28;1-6-11-22-18-27(25-15-10-9-13-23(22)25)28(29(19(2)3)20(4)5)26-17-16-21-12-7-8-14-24(21)26/h8,14-17,20-28,35H,2,7,9-13,18-19H2,1,3-6H3;8,12-15,18-26,33H,2,7,9-11,16-17H2,1,3-6H3;6,9-13,15-22,24,28H,1,7-8,14H2,2-5H3;6-10,12-20,22,26H,1,11H2,2-5H3
InChIKeyMVLYFZPZQRFQSM-UHFFFAOYSA-N
XLogP33.21
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds42
Heavy Atoms132
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001749.92
LogP ≤ 533.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine
CID 123301084
1,3-didodecyl-1H-indene
CID 177256728
CID 162143943
CID 162143943
1-butyl-1H-indene;zirconium
CID 175289141
1-[1-(1H-inden-1-yl)dec-1-enyl]-1H-indene
CID 151420770
2-(5-butylcyclopenta-1,4-dien-1-yl)-1-prop-2-enyl-1H-indene
CID 173021193
9-[2-(3-prop-2-enyl-1H-inden-1-yl)ethyl]-9H-fluorene
CID 15899658
9-(3-prop-2-enyl-3H-inden-1-yl)-9H-fluorene
CID 91048021
trimethyl-[(E)-(4-prop-2-enyl-4H-naphthalen-1-ylidene)methyl]silane
CID 164679289
9-[1-(1H-inden-1-yl)hex-5-en-2-yl]-9H-fluorene
CID 15492380
1-decyl-4-hex-5-enylbenzene
CID 91529966
1-decyl-4-oct-7-enylbenzene
CID 91553239

Frequently Asked Questions

What is the IUPAC name of N-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine (CID 159683314) is N-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine is C=CCC1C=C(B(C2C=C(CCCCCC)c3ccccc32)N(C(C)C)C(C)C)c2ccccc21.C=CCC1C=C(B(C2C=Cc3ccccc32)N(C(C)C)C(C)C)c2ccccc21.C=CCCCC1C=C(B(C2C=C(CCCCCC)c3ccccc32)N(C(C)C)C(C)C)c2ccccc21.C=CCCCC1C=C(B(C2C=Cc3ccccc32)N(C(C)C)C(C)C)c2ccccc21.
What is the InChIKey of N-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine?
The InChIKey is MVLYFZPZQRFQSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H48BN.C33H44BN.C29H36BN.C27H32BN/c1-7-9-11-13-19-29-25-35(33-23-17-15-21-31(29)33)36(37(26(3)4)27(5)6)34-24-28(18-12-10-8-2)30-20-14-16-22-32(30)34;1-7-9-10-11-17-27-23-33(31-21-15-13-19-29(27)31)34(35(24(3)4)25(5)6)32-22-26(16-8-2)28-18-12-14-20-30(28)32;1-6-7-8-14-24-20-29(27-17-12-11-15-25(24)27)30(31(21(2)3)22(4)5)28-19-18-23-13-9-10-16-26(23)28;1-6-11-22-18-27(25-15-10-9-13-23(22)25)28(29(19(2)3)20(4)5)26-17-16-21-12-7-8-14-24(21)26/h8,14-17,20-28,35H,2,7,9-13,18-19H2,1,3-6H3;8,12-15,18-26,33H,2,7,9-11,16-17H2,1,3-6H3;6,9-13,15-22,24,28H,1,7-8,14H2,2-5H3;6-10,12-20,22,26H,1,11H2,2-5H3.
What are the key properties of N-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine?
N-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine has a molecular weight of 1749.92 g/mol, XLogP of 33.21, 42 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-hexyl-1H-inden-1-yl)-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[(3-hexyl-1H-inden-1-yl)-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-pent-4-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine;N-[1H-inden-1-yl-(3-prop-2-enyl-3H-inden-1-yl)boranyl]-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 159683314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).