3-phenyl-N-propylpentan-2-amine

C14H23N — CID 66438754

IUPAC3-phenyl-N-propylpentan-2-amine
SMILESCCCNC(C)C(CC)c1ccccc1
InChIInChI=1S/C14H23N/c1-4-11-15-12(3)14(5-2)13-9-7-6-8-10-13/h6-10,12,14-15H,4-5,11H2,1-3H3
InChIKeyLYSHRMMVLBYYFR-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.57
Rot. Bonds6

About 3-phenyl-N-propylpentan-2-amine

3-phenyl-N-propylpentan-2-amine (PubChem CID 66438754) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is 3-phenyl-N-propylpentan-2-amine.

Molecular Properties

Compound Name3-phenyl-N-propylpentan-2-amine
PubChem CID66438754
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name3-phenyl-N-propylpentan-2-amine
SMILESCCCNC(C)C(CC)c1ccccc1
InChIInChI=1S/C14H23N/c1-4-11-15-12(3)14(5-2)13-9-7-6-8-10-13/h6-10,12,14-15H,4-5,11H2,1-3H3
InChIKeyLYSHRMMVLBYYFR-UHFFFAOYSA-N
XLogP3.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-propyl-3-[4-(trifluoromethyl)phenyl]pentan-2-amine
CID 63200596
(1S,2R)-1-phenyl-2-(propylamino)propan-1-ol
CID 14697423
4-phenyl-N-propylhex-1-en-3-amine
CID 105000798
1-methoxy-1-phenyl-N-propylpropan-2-amine
CID 116773234
N-(1-phenylethyl)propan-1-amine;hydrochloride
CID 16641251
7,7-dimethyl-3-phenyl-N-propyloctan-4-amine
CID 115849907
1-(2-chlorophenyl)-2-phenyl-N-propylbutan-1-amine
CID 115801219
1-(3-chlorophenyl)-2-phenyl-N-propylbutan-1-amine
CID 115811575
(1R,2R)-2-(butylamino)-1-phenylpropane-1-thiol
CID 129045615
[(2S)-1,1-diphenylbutan-2-yl]benzene
CID 101326862
3-(2-nitrophenyl)-N-propylpentan-2-amine
CID 63200441
3-benzyl-4-phenyl-N-propylbutan-2-amine
CID 66438552

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-N-propylpentan-2-amine?
The IUPAC name of 3-phenyl-N-propylpentan-2-amine (CID 66438754) is 3-phenyl-N-propylpentan-2-amine.
What is the SMILES notation for 3-phenyl-N-propylpentan-2-amine?
The canonical SMILES for 3-phenyl-N-propylpentan-2-amine is CCCNC(C)C(CC)c1ccccc1.
What is the InChIKey of 3-phenyl-N-propylpentan-2-amine?
The InChIKey is LYSHRMMVLBYYFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-4-11-15-12(3)14(5-2)13-9-7-6-8-10-13/h6-10,12,14-15H,4-5,11H2,1-3H3.
What are the key properties of 3-phenyl-N-propylpentan-2-amine?
3-phenyl-N-propylpentan-2-amine has a molecular weight of 205.34 g/mol, XLogP of 3.57, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-N-propylpentan-2-amine is sourced from PubChem (CID 66438754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).