2-(2-hydroxypentylamino)-N-phenylpropanamide

C14H22N2O2 — CID 113495789

IUPAC2-(2-hydroxypentylamino)-N-phenylpropanamide
SMILESCCCC(O)CNC(C)C(=O)Nc1ccccc1
InChIInChI=1S/C14H22N2O2/c1-3-7-13(17)10-15-11(2)14(18)16-12-8-5-4-6-9-12/h4-6,8-9,11,13,15,17H,3,7,10H2,1-2H3,(H,16,18)
InChIKeyJTWFDTCGNPLJOQ-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.76
Rot. Bonds7

About 2-(2-hydroxypentylamino)-N-phenylpropanamide

2-(2-hydroxypentylamino)-N-phenylpropanamide (PubChem CID 113495789) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-(2-hydroxypentylamino)-N-phenylpropanamide.

Molecular Properties

Compound Name2-(2-hydroxypentylamino)-N-phenylpropanamide
PubChem CID113495789
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-(2-hydroxypentylamino)-N-phenylpropanamide
SMILESCCCC(O)CNC(C)C(=O)Nc1ccccc1
InChIInChI=1S/C14H22N2O2/c1-3-7-13(17)10-15-11(2)14(18)16-12-8-5-4-6-9-12/h4-6,8-9,11,13,15,17H,3,7,10H2,1-2H3,(H,16,18)
InChIKeyJTWFDTCGNPLJOQ-UHFFFAOYSA-N
XLogP1.76
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(pentan-2-ylamino)-N-phenylpropanamide
CID 43083650
2-(2-ethoxypropylamino)-N-phenylpropanamide
CID 115663967
2-methyl-N-phenylpentanamide
CID 4627801
2-(octylamino)-N-phenylpropanamide
CID 78914372
2-(benzylamino)-N-phenylpropanamide
CID 4877973
(2S)-2-(benzylamino)-N-phenylpropanamide
CID 2443956
2-bromo-N-phenylpentanamide
CID 56980184
2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylpropanamide
CID 43401445
N-phenyl-2-(2-phenylethylamino)propanamide
CID 43083341
2-[[1-(hydroxymethyl)cyclopropyl]methylamino]-N-phenylpropanamide
CID 115454689
(2R)-2-methoxy-N-phenylpentanamide
CID 70193042
(2S)-2-(methylamino)-N-phenylpropanamide;hydrochloride
CID 70254304

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxypentylamino)-N-phenylpropanamide?
The IUPAC name of 2-(2-hydroxypentylamino)-N-phenylpropanamide (CID 113495789) is 2-(2-hydroxypentylamino)-N-phenylpropanamide.
What is the SMILES notation for 2-(2-hydroxypentylamino)-N-phenylpropanamide?
The canonical SMILES for 2-(2-hydroxypentylamino)-N-phenylpropanamide is CCCC(O)CNC(C)C(=O)Nc1ccccc1.
What is the InChIKey of 2-(2-hydroxypentylamino)-N-phenylpropanamide?
The InChIKey is JTWFDTCGNPLJOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-3-7-13(17)10-15-11(2)14(18)16-12-8-5-4-6-9-12/h4-6,8-9,11,13,15,17H,3,7,10H2,1-2H3,(H,16,18).
What are the key properties of 2-(2-hydroxypentylamino)-N-phenylpropanamide?
2-(2-hydroxypentylamino)-N-phenylpropanamide has a molecular weight of 250.34 g/mol, XLogP of 1.76, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxypentylamino)-N-phenylpropanamide is sourced from PubChem (CID 113495789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).