N-(3-cyclopentylpropyl)hexan-3-amine

C14H29N — CID 106008928

IUPACN-(3-cyclopentylpropyl)hexan-3-amine
SMILESCCCC(CC)NCCCC1CCCC1
InChIInChI=1S/C14H29N/c1-3-8-14(4-2)15-12-7-11-13-9-5-6-10-13/h13-15H,3-12H2,1-2H3
InChIKeyZRLWDCSNOBGGRJ-UHFFFAOYSA-N
MW211.39 g/mol
LogP4.13
Rot. Bonds8

About N-(3-cyclopentylpropyl)hexan-3-amine

N-(3-cyclopentylpropyl)hexan-3-amine (PubChem CID 106008928) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is N-(3-cyclopentylpropyl)hexan-3-amine.

Molecular Properties

Compound NameN-(3-cyclopentylpropyl)hexan-3-amine
PubChem CID106008928
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC NameN-(3-cyclopentylpropyl)hexan-3-amine
SMILESCCCC(CC)NCCCC1CCCC1
InChIInChI=1S/C14H29N/c1-3-8-14(4-2)15-12-7-11-13-9-5-6-10-13/h13-15H,3-12H2,1-2H3
InChIKeyZRLWDCSNOBGGRJ-UHFFFAOYSA-N
XLogP4.13
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 54.13
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

N-(2-cyclopentylethyl)heptan-3-amine
CID 63945725
N-(3-cyclopentylpropyl)-5-methylheptan-3-amine
CID 114136708
3-(3-cyclopentylpropylamino)pentanenitrile
CID 106010678
1-cyclohexyl-N-propylhexan-3-amine
CID 63400154
N-[2-(4-aminocyclohexyl)ethyl]-N'-hexan-3-ylpropane-1,3-diamine
CID 143882707
N-(3-cyclopentylpropyl)heptan-2-amine
CID 106008711
3-cyclotetradecyl-N-propan-2-ylpropan-1-amine
CID 91804535
N-[3-(cyclopropylmethoxy)propyl]hexan-3-amine
CID 103920888
N-[4-(2-aminoethyl)cyclohexyl]-N'-hexan-3-ylpropane-1,3-diamine
CID 143378355
6-(2-cyclobutylethoxy)-N-propylhexan-3-amine
CID 106201058
1-cyclohexyl-N-propylpentan-2-amine
CID 63413972
1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine
CID 115863549

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentylpropyl)hexan-3-amine?
The IUPAC name of N-(3-cyclopentylpropyl)hexan-3-amine (CID 106008928) is N-(3-cyclopentylpropyl)hexan-3-amine.
What is the SMILES notation for N-(3-cyclopentylpropyl)hexan-3-amine?
The canonical SMILES for N-(3-cyclopentylpropyl)hexan-3-amine is CCCC(CC)NCCCC1CCCC1.
What is the InChIKey of N-(3-cyclopentylpropyl)hexan-3-amine?
The InChIKey is ZRLWDCSNOBGGRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-3-8-14(4-2)15-12-7-11-13-9-5-6-10-13/h13-15H,3-12H2,1-2H3.
What are the key properties of N-(3-cyclopentylpropyl)hexan-3-amine?
N-(3-cyclopentylpropyl)hexan-3-amine has a molecular weight of 211.39 g/mol, XLogP of 4.13, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentylpropyl)hexan-3-amine is sourced from PubChem (CID 106008928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).