5-phenyl-N-propylpentan-1-amine

C14H23N — CID 62530615

IUPAC5-phenyl-N-propylpentan-1-amine
SMILESCCCNCCCCCc1ccccc1
InChIInChI=1S/C14H23N/c1-2-12-15-13-8-4-7-11-14-9-5-3-6-10-14/h3,5-6,9-10,15H,2,4,7-8,11-13H2,1H3
InChIKeyWUSVZCJHPCNSLZ-UHFFFAOYSA-N
MW205.35 g/mol
LogP3.40
Rot. Bonds8

About 5-phenyl-N-propylpentan-1-amine

5-phenyl-N-propylpentan-1-amine (PubChem CID 62530615) has the molecular formula C14H23N and a molecular weight of 205.35 g/mol. Its IUPAC name is 5-phenyl-N-propylpentan-1-amine.

Molecular Properties

Compound Name5-phenyl-N-propylpentan-1-amine
PubChem CID62530615
Molecular FormulaC14H23N
Molecular Weight205.35 g/mol
Exact Mass205.18
IUPAC Name5-phenyl-N-propylpentan-1-amine
SMILESCCCNCCCCCc1ccccc1
InChIInChI=1S/C14H23N/c1-2-12-15-13-8-4-7-11-14-9-5-3-6-10-14/h3,5-6,9-10,15H,2,4,7-8,11-13H2,1H3
InChIKeyWUSVZCJHPCNSLZ-UHFFFAOYSA-N
XLogP3.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.35
LogP ≤ 53.40
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'-(4-phenylbutyl)-N-propylethane-1,2-diamine
CID 113405226
N-(4-phenylbutyl)hexan-1-amine
CID 54151992
11-phenyl-N-undecylundecan-1-amine
CID 175593224
3-phenyl-N-propylpropan-1-amine;hydrochloride
CID 75357720
N-(3-phenylpropyl)undecan-1-amine
CID 10469447
N-ethyl-17-phenylheptadecan-1-amine
CID 139804977
N-(2-phenylethyl)undecan-1-amine
CID 141108004
3-(3-phenylpropoxy)-N-propylpropan-1-amine
CID 62485607
6-(4-fluorophenyl)-N-propylhexan-1-amine
CID 65308488
5-(4-fluorophenyl)-N-propylpentan-1-amine
CID 65300450
5-(4-phenylbutylamino)pentan-1-ol
CID 107317257
N-[2-(4-methylphenyl)ethyl]-5-phenylpentan-1-amine
CID 18790228

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-N-propylpentan-1-amine?
The IUPAC name of 5-phenyl-N-propylpentan-1-amine (CID 62530615) is 5-phenyl-N-propylpentan-1-amine.
What is the SMILES notation for 5-phenyl-N-propylpentan-1-amine?
The canonical SMILES for 5-phenyl-N-propylpentan-1-amine is CCCNCCCCCc1ccccc1.
What is the InChIKey of 5-phenyl-N-propylpentan-1-amine?
The InChIKey is WUSVZCJHPCNSLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-2-12-15-13-8-4-7-11-14-9-5-3-6-10-14/h3,5-6,9-10,15H,2,4,7-8,11-13H2,1H3.
What are the key properties of 5-phenyl-N-propylpentan-1-amine?
5-phenyl-N-propylpentan-1-amine has a molecular weight of 205.35 g/mol, XLogP of 3.40, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-N-propylpentan-1-amine is sourced from PubChem (CID 62530615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).