2-cyclopentyl-N-propylundecan-1-amine

C19H39N — CID 115926613

IUPAC2-cyclopentyl-N-propylundecan-1-amine
SMILESCCCCCCCCCC(CNCCC)C1CCCC1
InChIInChI=1S/C19H39N/c1-3-5-6-7-8-9-10-15-19(17-20-16-4-2)18-13-11-12-14-18/h18-20H,3-17H2,1-2H3
InChIKeyZIHGJHGZMJWGDL-UHFFFAOYSA-N
MW281.53 g/mol
LogP5.93
Rot. Bonds13

About 2-cyclopentyl-N-propylundecan-1-amine

2-cyclopentyl-N-propylundecan-1-amine (PubChem CID 115926613) has the molecular formula C19H39N and a molecular weight of 281.53 g/mol. Its IUPAC name is 2-cyclopentyl-N-propylundecan-1-amine.

Molecular Properties

Compound Name2-cyclopentyl-N-propylundecan-1-amine
PubChem CID115926613
Molecular FormulaC19H39N
Molecular Weight281.53 g/mol
Exact Mass281.31
IUPAC Name2-cyclopentyl-N-propylundecan-1-amine
SMILESCCCCCCCCCC(CNCCC)C1CCCC1
InChIInChI=1S/C19H39N/c1-3-5-6-7-8-9-10-15-19(17-20-16-4-2)18-13-11-12-14-18/h18-20H,3-17H2,1-2H3
InChIKeyZIHGJHGZMJWGDL-UHFFFAOYSA-N
XLogP5.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.53
LogP ≤ 55.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-cyclopentyl-N-propyldecan-1-amine
CID 112569910
2-cyclopentyl-N-(2-methoxyethyl)octan-1-amine
CID 112570187
2-cyclohexyl-N-propylpentan-1-amine
CID 82932453
2-cyclopentyl-N-methyldodecan-1-amine
CID 112569791
hexadecan-8-ylcyclohexane
CID 91510029
2-cyclopentyl-N-propan-2-yloctan-1-amine
CID 112569984
undecan-5-ylcyclohexane
CID 524419
nonan-3-ylcyclopentane
CID 19893531
2-cyclopentyl-5,5-dimethyl-N-propylhexan-1-amine
CID 112569928
2-cyclopentyl-4-methyl-N-propylheptan-1-amine
CID 112569912
2-cyclopentyloctan-1-amine
CID 112569591
1-chlorododecan-2-ylcyclopentane
CID 112570395

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-propylundecan-1-amine?
The IUPAC name of 2-cyclopentyl-N-propylundecan-1-amine (CID 115926613) is 2-cyclopentyl-N-propylundecan-1-amine.
What is the SMILES notation for 2-cyclopentyl-N-propylundecan-1-amine?
The canonical SMILES for 2-cyclopentyl-N-propylundecan-1-amine is CCCCCCCCCC(CNCCC)C1CCCC1.
What is the InChIKey of 2-cyclopentyl-N-propylundecan-1-amine?
The InChIKey is ZIHGJHGZMJWGDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H39N/c1-3-5-6-7-8-9-10-15-19(17-20-16-4-2)18-13-11-12-14-18/h18-20H,3-17H2,1-2H3.
What are the key properties of 2-cyclopentyl-N-propylundecan-1-amine?
2-cyclopentyl-N-propylundecan-1-amine has a molecular weight of 281.53 g/mol, XLogP of 5.93, 13 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-propylundecan-1-amine is sourced from PubChem (CID 115926613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).