2-phenylpentan-1-amine

C11H17N — CID 14321247

IUPAC2-phenylpentan-1-amine
SMILESCCCC(CN)c1ccccc1
InChIInChI=1S/C11H17N/c1-2-6-11(9-12)10-7-4-3-5-8-10/h3-5,7-8,11H,2,6,9,12H2,1H3
InChIKeySQMNYSQPHYHTSO-UHFFFAOYSA-N
MW163.26 g/mol
LogP2.53
Rot. Bonds4

About 2-phenylpentan-1-amine

2-phenylpentan-1-amine (PubChem CID 14321247) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is 2-phenylpentan-1-amine.

Molecular Properties

Compound Name2-phenylpentan-1-amine
PubChem CID14321247
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name2-phenylpentan-1-amine
SMILESCCCC(CN)c1ccccc1
InChIInChI=1S/C11H17N/c1-2-6-11(9-12)10-7-4-3-5-8-10/h3-5,7-8,11H,2,6,9,12H2,1H3
InChIKeySQMNYSQPHYHTSO-UHFFFAOYSA-N
XLogP2.53
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-phenylundecan-1-amine
CID 57256894
2-phenylbutane-1,4-diamine
CID 16770348
5-ethyl-2-phenylheptan-1-amine
CID 82935011
4-butoxy-2-phenylbutan-1-amine
CID 65429103
2-phenylpentane-1,5-diamine
CID 22770284
1-chloropentan-2-ylbenzene
CID 524326
1,1-diphenylhexan-3-ylbenzene
CID 57087261
2-(4-phenylphenyl)hexan-1-amine
CID 121467477
(2R)-2,4-diphenylbutan-1-amine
CID 10998696
2-phenyl-3-propylsulfanylpropan-1-amine
CID 64535835
2-(4-ethoxyphenyl)pentan-1-amine
CID 112507782
4-(5-ethylthiophen-2-yl)-2-phenylbutan-1-amine
CID 81010267

Frequently Asked Questions

What is the IUPAC name of 2-phenylpentan-1-amine?
The IUPAC name of 2-phenylpentan-1-amine (CID 14321247) is 2-phenylpentan-1-amine.
What is the SMILES notation for 2-phenylpentan-1-amine?
The canonical SMILES for 2-phenylpentan-1-amine is CCCC(CN)c1ccccc1.
What is the InChIKey of 2-phenylpentan-1-amine?
The InChIKey is SQMNYSQPHYHTSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-2-6-11(9-12)10-7-4-3-5-8-10/h3-5,7-8,11H,2,6,9,12H2,1H3.
What are the key properties of 2-phenylpentan-1-amine?
2-phenylpentan-1-amine has a molecular weight of 163.26 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylpentan-1-amine is sourced from PubChem (CID 14321247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).