6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine

C16H28N2 — CID 123486286

IUPAC6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine
SMILES[H]/N=C(/C(CCCCN)=C1CCCC1)C1CCCC1
InChIInChI=1S/C16H28N2/c17-12-6-5-11-15(13-7-1-2-8-13)16(18)14-9-3-4-10-14/h14,18H,1-12,17H2/b18-16+
InChIKeyFAOSPYMHFJVCJD-FBMGVBCBSA-N
MW248.41 g/mol
LogP4.20
Rot. Bonds6

About 6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine

6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine (PubChem CID 123486286) has the molecular formula C16H28N2 and a molecular weight of 248.41 g/mol. Its IUPAC name is 6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine.

Molecular Properties

Compound Name6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine
PubChem CID123486286
Molecular FormulaC16H28N2
Molecular Weight248.41 g/mol
Exact Mass248.23
IUPAC Name6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine
SMILES[H]/N=C(/C(CCCCN)=C1CCCC1)C1CCCC1
InChIInChI=1S/C16H28N2/c17-12-6-5-11-15(13-7-1-2-8-13)16(18)14-9-3-4-10-14/h14,18H,1-12,17H2/b18-16+
InChIKeyFAOSPYMHFJVCJD-FBMGVBCBSA-N
XLogP4.20
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.41
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

8-Cyclopentyl-7-cyclopentylidene-8-iminooctan-1-amine
CID 123312933
6-Imino-7,9-dimethyl-5-(4-methylpentan-2-ylidene)decan-1-amine
CID 123826399
13-Ethyl-11-hexan-3-ylidene-12-iminohexadecan-1-amine
CID 123894035
8-Imino-9,11-dimethyl-7-(4-methylpentan-2-ylidene)dodecan-1-amine
CID 123996683

Frequently Asked Questions

What is the IUPAC name of 6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine?
The IUPAC name of 6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine (CID 123486286) is 6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine.
What is the SMILES notation for 6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine?
The canonical SMILES for 6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine is [H]/N=C(/C(CCCCN)=C1CCCC1)C1CCCC1.
What is the InChIKey of 6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine?
The InChIKey is FAOSPYMHFJVCJD-FBMGVBCBSA-N. The full InChI is InChI=1S/C16H28N2/c17-12-6-5-11-15(13-7-1-2-8-13)16(18)14-9-3-4-10-14/h14,18H,1-12,17H2/b18-16+.
What are the key properties of 6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine?
6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine has a molecular weight of 248.41 g/mol, XLogP of 4.20, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopentyl-5-cyclopentylidene-6-iminohexan-1-amine is sourced from PubChem (CID 123486286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).