2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine

C10H12N2 — CID 123264569

IUPAC2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine
SMILES[H]/N=C1\C=CCC1C1=CC=CC1N
InChIInChI=1S/C10H12N2/c11-9-5-1-3-7(9)8-4-2-6-10(8)12/h1-3,5-6,8-9,12H,4,11H2/b12-10+
InChIKeyVRHCCRWIOKLYNB-ZRDIBKRKSA-N
MW160.22 g/mol
LogP1.41
Rot. Bonds1

About 2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine

2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine (PubChem CID 123264569) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine.

Molecular Properties

Compound Name2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine
PubChem CID123264569
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine
SMILES[H]/N=C1\C=CCC1C1=CC=CC1N
InChIInChI=1S/C10H12N2/c11-9-5-1-3-7(9)8-4-2-6-10(8)12/h1-3,5-6,8-9,12H,4,11H2/b12-10+
InChIKeyVRHCCRWIOKLYNB-ZRDIBKRKSA-N
XLogP1.41
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(4E,6E,8E)-6-ethanimidoyl-4-fluoro-11-methyl-3-propyldodeca-4,6,8,10-tetraen-2-amine
CID 167083150
1,2,3,3a-Tetrahydrocyclopenta[b]indol-1-ylmethanamine
CID 67683529
2-Imino-1-(6-methylcyclohexa-1,3-dien-1-yl)ethanamine
CID 89153800
4-Imino-5,6-dimethylcyclohex-2-en-1-amine
CID 123143860
4-Imino-2,5-dimethylcyclohex-2-en-1-amine
CID 123524045
5-(2-Iminocyclopent-3-en-1-ylidene)cyclopent-2-en-1-amine
CID 123775792
2,3-dimethyl-6-(3-methylbut-2-en-2-yl)-7,7a-dihydro-6H-indol-7-amine
CID 164088563

Frequently Asked Questions

What is the IUPAC name of 2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine?
The IUPAC name of 2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine (CID 123264569) is 2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine.
What is the SMILES notation for 2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine?
The canonical SMILES for 2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine is [H]/N=C1\C=CCC1C1=CC=CC1N.
What is the InChIKey of 2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine?
The InChIKey is VRHCCRWIOKLYNB-ZRDIBKRKSA-N. The full InChI is InChI=1S/C10H12N2/c11-9-5-1-3-7(9)8-4-2-6-10(8)12/h1-3,5-6,8-9,12H,4,11H2/b12-10+.
What are the key properties of 2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine?
2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine has a molecular weight of 160.22 g/mol, XLogP of 1.41, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine is sourced from PubChem (CID 123264569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).