(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide

C14H19N3O2 — CID 55030074

IUPAC(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide
SMILESN[C@H](Cc1ccccc1)C(=O)NCC(=O)NC1CC1
InChIInChI=1S/C14H19N3O2/c15-12(8-10-4-2-1-3-5-10)14(19)16-9-13(18)17-11-6-7-11/h1-5,11-12H,6-9,15H2,(H,16,19)(H,17,18)/t12-/m1/s1
InChIKeyUKJLYYXPWQFZPI-GFCCVEGCSA-N
MW261.32 g/mol
LogP-0.05
Rot. Bonds6

About (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide

(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide (PubChem CID 55030074) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide
PubChem CID55030074
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide
SMILESN[C@H](Cc1ccccc1)C(=O)NCC(=O)NC1CC1
InChIInChI=1S/C14H19N3O2/c15-12(8-10-4-2-1-3-5-10)14(19)16-9-13(18)17-11-6-7-11/h1-5,11-12H,6-9,15H2,(H,16,19)(H,17,18)/t12-/m1/s1
InChIKeyUKJLYYXPWQFZPI-GFCCVEGCSA-N
XLogP-0.05
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[(2S)-2-amino-3-phenylpropanoyl]amino]cyclohexane-1-carboxamide;hydrochloride
CID 119319374
(2S)-2-amino-N-(4-methylcyclohexyl)-3-phenylpropanamide
CID 14837100
(2S)-2-amino-3-phenyl-N-(4-phenylcyclohexyl)propanamide
CID 119285391
cis-(1R,3S)-3-[[(2S)-2-amino-3-phenylpropanoyl]amino]cyclopentane-1-carboxylic acid
CID 106322850
2-amino-N-(4-ethylcyclohexyl)-3-phenylpropanamide
CID 61470376
2-amino-N-[2-(ethylamino)-2-oxoethyl]-3-phenylpropanamide;hydrochloride
CID 119271418
ethyl 4-[(2-amino-3-phenylpropanoyl)amino]cyclohexane-1-carboxylate
CID 119297434
(2S)-2-amino-N-(1-methylpiperidin-4-yl)-3-phenylpropanamide
CID 91079232
(2S)-2-amino-N-phenacyl-3-phenylpropanamide
CID 54565286
3-amino-N-cyclopropyl-2-hydroxy-4-phenylbutanamide
CID 66644721
N-[2-(cyclopropylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide
CID 110625050
(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]butanamide
CID 79025256

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide?
The IUPAC name of (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide (CID 55030074) is (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide?
The canonical SMILES for (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide is N[C@H](Cc1ccccc1)C(=O)NCC(=O)NC1CC1.
What is the InChIKey of (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide?
The InChIKey is UKJLYYXPWQFZPI-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H19N3O2/c15-12(8-10-4-2-1-3-5-10)14(19)16-9-13(18)17-11-6-7-11/h1-5,11-12H,6-9,15H2,(H,16,19)(H,17,18)/t12-/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide?
(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide has a molecular weight of 261.32 g/mol, XLogP of -0.05, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3-phenylpropanamide is sourced from PubChem (CID 55030074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).