4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine

C19H38NP — CID 126559508

IUPAC4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine
SMILESC=C(P)CCNC(=C)CC(C)(C)CCC(C)C(C)C(C)C
InChIInChI=1S/C19H38NP/c1-14(2)18(6)15(3)9-11-19(7,8)13-16(4)20-12-10-17(5)21/h14-15,18,20H,4-5,9-13,21H2,1-3,6-8H3
InChIKeyQVNXHMBNCZKOMR-UHFFFAOYSA-N
MW311.49 g/mol
LogP5.99
Rot. Bonds11

About 4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine

4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine (PubChem CID 126559508) has the molecular formula C19H38NP and a molecular weight of 311.49 g/mol. Its IUPAC name is 4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine.

Molecular Properties

Compound Name4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine
PubChem CID126559508
Molecular FormulaC19H38NP
Molecular Weight311.49 g/mol
Exact Mass311.27
IUPAC Name4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine
SMILESC=C(P)CCNC(=C)CC(C)(C)CCC(C)C(C)C(C)C
InChIInChI=1S/C19H38NP/c1-14(2)18(6)15(3)9-11-19(7,8)13-16(4)20-12-10-17(5)21/h14-15,18,20H,4-5,9-13,21H2,1-3,6-8H3
InChIKeyQVNXHMBNCZKOMR-UHFFFAOYSA-N
XLogP5.99
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500311.49
LogP ≤ 55.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

N-(3-fluorobut-3-enyl)-4,4,7,8-tetramethylnon-1-en-2-amine
CID 126559121
2-fluoro-3,3,10-trimethyl-N-(3-methylbut-1-en-2-yl)undec-10-en-1-amine
CID 169881078
CID 173706066
CID 173706066
CID 173706068
CID 173706068
(3R,5R)-3-[(2S)-butan-2-yl]-N-ethyl-5-methylhept-1-en-2-amine
CID 87112833
3-ethyl-2-N-(4-methyl-3-tetradecan-2-ylhexadec-1-en-2-yl)-4-N-propan-2-ylpentane-2,4-diamine
CID 89152555
N-(2-cycloundecylethyl)but-1-en-2-amine
CID 89191957
N-heptan-4-yl-4,8-dimethylnona-1,8-dien-2-amine
CID 126510679
4,4,6,7,7,8-hexamethyl-N-(4-methylpent-1-en-2-yl)nonan-2-amine
CID 126692502
N-(3,5-dimethylhexan-2-yl)-3,5-dimethyl-3-propan-2-ylhex-1-en-2-amine
CID 126706749
2,2,4-trimethyl-N-(3-methylbut-1-en-2-yl)-N'-(3-methylpent-1-en-2-yl)hexane-1,6-diamine
CID 126746319
N-(3,3-dimethylpent-1-en-2-yl)-2-octadecylhenicosan-1-amine
CID 126747827

Frequently Asked Questions

What is the IUPAC name of 4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine?
The IUPAC name of 4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine (CID 126559508) is 4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine.
What is the SMILES notation for 4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine?
The canonical SMILES for 4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine is C=C(P)CCNC(=C)CC(C)(C)CCC(C)C(C)C(C)C.
What is the InChIKey of 4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine?
The InChIKey is QVNXHMBNCZKOMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38NP/c1-14(2)18(6)15(3)9-11-19(7,8)13-16(4)20-12-10-17(5)21/h14-15,18,20H,4-5,9-13,21H2,1-3,6-8H3.
What are the key properties of 4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine?
4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine has a molecular weight of 311.49 g/mol, XLogP of 5.99, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,7,8,9-pentamethyl-N-(3-phosphanylbut-3-enyl)dec-1-en-2-amine is sourced from PubChem (CID 126559508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).