3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide

C16H23N3O2 — CID 119807871

IUPAC3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide
SMILESC[C@H](c1ccccc1)N(CC(N)=O)C(=O)C1CCC(N)C1
InChIInChI=1S/C16H23N3O2/c1-11(12-5-3-2-4-6-12)19(10-15(18)20)16(21)13-7-8-14(17)9-13/h2-6,11,13-14H,7-10,17H2,1H3,(H2,18,20)/t11-,13?,14?/m1/s1
InChIKeyIWEPQAZFINQKDN-LMWSTFAQSA-N
MW289.38 g/mol
LogP1.19
Rot. Bonds5

About 3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide

3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide (PubChem CID 119807871) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide
PubChem CID119807871
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide
SMILESC[C@H](c1ccccc1)N(CC(N)=O)C(=O)C1CCC(N)C1
InChIInChI=1S/C16H23N3O2/c1-11(12-5-3-2-4-6-12)19(10-15(18)20)16(21)13-7-8-14(17)9-13/h2-6,11,13-14H,7-10,17H2,1H3,(H2,18,20)/t11-,13?,14?/m1/s1
InChIKeyIWEPQAZFINQKDN-LMWSTFAQSA-N
XLogP1.19
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119807872
3-amino-N-(cyclobutylmethyl)-N-(1-phenylethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119799535
3-amino-N-benzyl-N-propan-2-ylcyclopentane-1-carboxamide;hydrochloride
CID 119676287
3-amino-N-methyl-N-(2-methyl-1-phenylpropyl)cyclopentane-1-carboxamide
CID 119783511
3-amino-N-(2-amino-2-oxoethyl)-N-benzylcyclopentane-1-carboxamide
CID 119783021
(2S)-2-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]propanamide;hydrochloride
CID 119337389
N-(2-amino-2-oxoethyl)-2-(methylamino)-N-[(1R)-1-phenylethyl]acetamide
CID 119807877
3-amino-N-[2-(diethylamino)-2-phenylethyl]cyclopentane-1-carboxamide
CID 119399183
3-amino-N-[1-(2-chlorophenyl)ethyl]-N-cyclopropylcyclopentane-1-carboxamide;hydrochloride
CID 119715144
3-amino-N-ethyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]cyclohexane-1-carboxamide
CID 119794789
3-amino-N-(2-methylpropyl)-N-propan-2-ylcyclopentane-1-carboxamide;hydrochloride
CID 119730925
3-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)cyclopentane-1-carboxamide
CID 119749330

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide (CID 119807871) is 3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide is C[C@H](c1ccccc1)N(CC(N)=O)C(=O)C1CCC(N)C1.
What is the InChIKey of 3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide?
The InChIKey is IWEPQAZFINQKDN-LMWSTFAQSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-11(12-5-3-2-4-6-12)19(10-15(18)20)16(21)13-7-8-14(17)9-13/h2-6,11,13-14H,7-10,17H2,1H3,(H2,18,20)/t11-,13?,14?/m1/s1.
What are the key properties of 3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide?
3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 1.19, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-amino-2-oxoethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119807871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).