1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid

C15H20N2O3 — CID 115433544

IUPAC1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid
SMILESN[C@@H](C(=O)NCC1(C(=O)O)CCCC1)c1ccccc1
InChIInChI=1S/C15H20N2O3/c16-12(11-6-2-1-3-7-11)13(18)17-10-15(14(19)20)8-4-5-9-15/h1-3,6-7,12H,4-5,8-10,16H2,(H,17,18)(H,19,20)/t12-/m1/s1
InChIKeyCOKYJYHHAYOWJW-GFCCVEGCSA-N
MW276.34 g/mol
LogP1.45
Rot. Bonds5

About 1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid

1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid (PubChem CID 115433544) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid
PubChem CID115433544
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid
SMILESN[C@@H](C(=O)NCC1(C(=O)O)CCCC1)c1ccccc1
InChIInChI=1S/C15H20N2O3/c16-12(11-6-2-1-3-7-11)13(18)17-10-15(14(19)20)8-4-5-9-15/h1-3,6-7,12H,4-5,8-10,16H2,(H,17,18)(H,19,20)/t12-/m1/s1
InChIKeyCOKYJYHHAYOWJW-GFCCVEGCSA-N
XLogP1.45
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 115436319
1-[[(3-amino-2-methyl-3-phenylpropanoyl)amino]methyl]cyclobutane-1-carboxylic acid
CID 115445799
1-[[(2-amino-2-thiophen-2-ylacetyl)amino]methyl]cycloheptane-1-carboxylic acid
CID 115444446
(2S)-2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-2-phenylacetamide
CID 104897629
1-[[[2-amino-2-(1-methylpyrazol-4-yl)acetyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 115436333
1-[[(2-ethoxy-2-phenylacetyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 120543746
2-amino-2-phenyl-N-[(1-propan-2-ylcyclopropyl)methyl]acetamide;hydrochloride
CID 119333913
(2R)-2-amino-N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]-2-phenylacetamide
CID 65120039
(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide
CID 81130040
2-amino-N-[[1-(3-bromophenyl)cyclopropyl]methyl]-2-phenylacetamide
CID 119325130
1-(phenylmethoxycarbonylaminomethyl)cyclopentane-1-carboxylic acid
CID 69223765
(2S)-2-amino-N-[1-(hydroxymethyl)cyclohexyl]-2-phenylacetamide
CID 104897811

Frequently Asked Questions

What is the IUPAC name of 1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid (CID 115433544) is 1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid is N[C@@H](C(=O)NCC1(C(=O)O)CCCC1)c1ccccc1.
What is the InChIKey of 1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid?
The InChIKey is COKYJYHHAYOWJW-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H20N2O3/c16-12(11-6-2-1-3-7-11)13(18)17-10-15(14(19)20)8-4-5-9-15/h1-3,6-7,12H,4-5,8-10,16H2,(H,17,18)(H,19,20)/t12-/m1/s1.
What are the key properties of 1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid?
1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid has a molecular weight of 276.34 g/mol, XLogP of 1.45, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 115433544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).