N-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine

C15H15N — CID 135248198

IUPACN-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine
SMILESC=C/C=C\C=C/Nc1cccc2c1CC=C2
InChIInChI=1S/C15H15N/c1-2-3-4-5-12-16-15-11-7-9-13-8-6-10-14(13)15/h2-9,11-12,16H,1,10H2/b4-3-,12-5-
InChIKeyGOOPLINDVMABPD-HVSXSXIDSA-N
MW209.29 g/mol
LogP3.92
Rot. Bonds4

About N-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine

N-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine (PubChem CID 135248198) has the molecular formula C15H15N and a molecular weight of 209.29 g/mol. Its IUPAC name is N-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine.

Molecular Properties

Compound NameN-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine
PubChem CID135248198
Molecular FormulaC15H15N
Molecular Weight209.29 g/mol
Exact Mass209.12
IUPAC NameN-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine
SMILESC=C/C=C\C=C/Nc1cccc2c1CC=C2
InChIInChI=1S/C15H15N/c1-2-3-4-5-12-16-15-11-7-9-13-8-6-10-14(13)15/h2-9,11-12,16H,1,10H2/b4-3-,12-5-
InChIKeyGOOPLINDVMABPD-HVSXSXIDSA-N
XLogP3.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-3-methylaniline
CID 7603
N-(1-Naphthyl)ethylenediamine
CID 15107
Indoline
CID 10328
Benzylaniline
CID 66028
N-(1-ethylpropyl)-3,4-dimethylaniline
CID 91984
N-Ethyl-1-naphthalenamine
CID 67043
1,2,3,4-Tetrahydroquinoline
CID 69460
2-Methylindoline
CID 23305
2,N-Dimethylaniline
CID 69137
N-(3-Methylphenyl)benzenemethanamine
CID 222281
Propanenitrile, 3-[(3-methylphenyl)amino]-
CID 119683
Benzenamine, N-ethyl-2-methyl-
CID 7201

Frequently Asked Questions

What is the IUPAC name of N-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine?
The IUPAC name of N-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine (CID 135248198) is N-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine.
What is the SMILES notation for N-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine?
The canonical SMILES for N-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine is C=C/C=C\C=C/Nc1cccc2c1CC=C2.
What is the InChIKey of N-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine?
The InChIKey is GOOPLINDVMABPD-HVSXSXIDSA-N. The full InChI is InChI=1S/C15H15N/c1-2-3-4-5-12-16-15-11-7-9-13-8-6-10-14(13)15/h2-9,11-12,16H,1,10H2/b4-3-,12-5-.
What are the key properties of N-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine?
N-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine has a molecular weight of 209.29 g/mol, XLogP of 3.92, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1Z,3Z)-hexa-1,3,5-trienyl]-3H-inden-4-amine is sourced from PubChem (CID 135248198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).