(1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine

C20H27N — CID 143924466

IUPAC(1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine
SMILESC=C(/C=C\N(C)C(=C)CC1CCCC1)/C=C/C1=CC=CC1
InChIInChI=1S/C20H27N/c1-17(12-13-19-8-4-5-9-19)14-15-21(3)18(2)16-20-10-6-7-11-20/h4-5,8,12-15,20H,1-2,6-7,9-11,16H2,3H3/b13-12+,15-14-
InChIKeyWUCKOLQXMNDMCW-NQDQBVNISA-N
MW281.44 g/mol
LogP5.52
Rot. Bonds7

About (1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine

(1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine (PubChem CID 143924466) has the molecular formula C20H27N and a molecular weight of 281.44 g/mol. Its IUPAC name is (1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine.

Molecular Properties

Compound Name(1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine
PubChem CID143924466
Molecular FormulaC20H27N
Molecular Weight281.44 g/mol
Exact Mass281.21
IUPAC Name(1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine
SMILESC=C(/C=C\N(C)C(=C)CC1CCCC1)/C=C/C1=CC=CC1
InChIInChI=1S/C20H27N/c1-17(12-13-19-8-4-5-9-19)14-15-21(3)18(2)16-20-10-6-7-11-20/h4-5,8,12-15,20H,1-2,6-7,9-11,16H2,3H3/b13-12+,15-14-
InChIKeyWUCKOLQXMNDMCW-NQDQBVNISA-N
XLogP5.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.44
LogP ≤ 55.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-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

(2E)-1-[(4,4-difluorocyclohexyl)methyl]-2-[(E)-4-methyl-2-methylidene-3-prop-1-en-2-ylhex-3-enylidene]-3H-pyrrole
CID 135294797
N,N,3-trimethyl-2,3-dihydropentalen-1-amine
CID 90987640
N,N,2,3,4,5,6-heptamethyl-2,3-dihydropentalen-1-amine;(E,3E)-N,N,2-trimethyl-3-(2,3,4-trimethylcyclopenta-2,4-dien-1-ylidene)but-1-en-1-amine
CID 53968278
2-[4,5-di(butan-2-yl)cyclopenta-1,4-dien-1-yl]-N,N-dimethylethanamine
CID 54056769
N,N-bis(2-ethylhexyl)-3-propan-2-ylidenecyclohexen-1-amine
CID 68377409
(2E,3Z)-3-(3,5-dimethylhexylidene)-2-ethylidene-1-methylpyrrole
CID 88271794
(1R)-1-[(1R)-2-butan-2-ylcyclopenta-2,4-dien-1-yl]-N,N-dimethylethanamine
CID 89175118
1-Methyl-6-(6-methylcyclohexen-1-yl)pyridine
CID 90698309
3-[(Z)-but-1-enyl]-1-[(E)-but-1-enyl]-3a,6,7,7a-tetrahydroindole
CID 118259231
N-(2-cyclohexa-1,3-dien-1-ylethenyl)-4-methyl-N-penta-2,4-dien-2-ylhex-1-en-2-amine
CID 123726238
(E)-N-[(1E,3Z)-hexa-1,3,5-trienyl]-N-iodo-2-methyl-8-propyldodec-5-en-6-amine
CID 124112802
(Z)-1-cyclopentyl-N,N-dipropylpent-1-en-1-amine
CID 126711275

Frequently Asked Questions

What is the IUPAC name of (1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine?
The IUPAC name of (1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine (CID 143924466) is (1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine.
What is the SMILES notation for (1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine?
The canonical SMILES for (1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine is C=C(/C=C\N(C)C(=C)CC1CCCC1)/C=C/C1=CC=CC1.
What is the InChIKey of (1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine?
The InChIKey is WUCKOLQXMNDMCW-NQDQBVNISA-N. The full InChI is InChI=1S/C20H27N/c1-17(12-13-19-8-4-5-9-19)14-15-21(3)18(2)16-20-10-6-7-11-20/h4-5,8,12-15,20H,1-2,6-7,9-11,16H2,3H3/b13-12+,15-14-.
What are the key properties of (1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine?
(1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine has a molecular weight of 281.44 g/mol, XLogP of 5.52, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,4E)-5-cyclopenta-1,3-dien-1-yl-N-(3-cyclopentylprop-1-en-2-yl)-N-methyl-3-methylidenepenta-1,4-dien-1-amine is sourced from PubChem (CID 143924466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).