2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid

C14H19N3O3 — CID 107339076

IUPAC2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid
SMILESNc1ccc(CC(=O)NCC2CCCC2C(=O)O)nc1
InChIInChI=1S/C14H19N3O3/c15-10-4-5-11(16-8-10)6-13(18)17-7-9-2-1-3-12(9)14(19)20/h4-5,8-9,12H,1-3,6-7,15H2,(H,17,18)(H,19,20)
InChIKeyPAFDPFYZVOEBRK-UHFFFAOYSA-N
MW277.32 g/mol
LogP0.82
Rot. Bonds5

About 2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid

2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid (PubChem CID 107339076) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is 2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid
PubChem CID107339076
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Name2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid
SMILESNc1ccc(CC(=O)NCC2CCCC2C(=O)O)nc1
InChIInChI=1S/C14H19N3O3/c15-10-4-5-11(16-8-10)6-13(18)17-7-9-2-1-3-12(9)14(19)20/h4-5,8-9,12H,1-3,6-7,15H2,(H,17,18)(H,19,20)
InChIKeyPAFDPFYZVOEBRK-UHFFFAOYSA-N
XLogP0.82
TPSA105.31 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 50.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-amino-2-pyridinyl)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride
CID 120634591
2-(5-amino-2-pyridinyl)-N-[(3-methylcyclopentyl)methyl]acetamide
CID 107413069
2-(5-amino-2-pyridinyl)-N-(2-cyclopropylethyl)acetamide;hydrochloride
CID 120633863
1-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid
CID 107339432
2-[(pyridazine-4-carbonylamino)methyl]cyclopentane-1-carboxylic acid
CID 113439196
trans-(1S,2R)-2-[[[2-(4-fluorophenyl)acetyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 108755751
2-(5-amino-2-pyridinyl)-N-(2-methylcycloheptyl)acetamide
CID 107339059
2-(5-amino-2-pyridinyl)-N-(2,2-difluoroethyl)acetamide;hydrochloride
CID 120632231
4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide
CID 107337718
2-(5-amino-2-pyridinyl)-N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]acetamide
CID 107339008
2-(5-amino-2-pyridinyl)-N-(1,4-dithian-2-ylmethyl)acetamide;hydrochloride
CID 120633463
2-(5-amino-2-pyridinyl)-1-(2,6-dimethylpiperidin-1-yl)ethanone
CID 107337486

Frequently Asked Questions

What is the IUPAC name of 2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid?
The IUPAC name of 2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid (CID 107339076) is 2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid is Nc1ccc(CC(=O)NCC2CCCC2C(=O)O)nc1.
What is the InChIKey of 2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid?
The InChIKey is PAFDPFYZVOEBRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c15-10-4-5-11(16-8-10)6-13(18)17-7-9-2-1-3-12(9)14(19)20/h4-5,8-9,12H,1-3,6-7,15H2,(H,17,18)(H,19,20).
What are the key properties of 2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid?
2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid has a molecular weight of 277.32 g/mol, XLogP of 0.82, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[[2-(5-amino-2-pyridinyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 107339076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).