2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid

C15H20N2O4 — CID 2348766

IUPAC2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid
SMILESCOc1ccc(NC(=O)CC2(CC(=O)O)CCCC2)cn1
InChIInChI=1S/C15H20N2O4/c1-21-13-5-4-11(10-16-13)17-12(18)8-15(9-14(19)20)6-2-3-7-15/h4-5,10H,2-3,6-9H2,1H3,(H,17,18)(H,19,20)
InChIKeyBRBUPHHFPYGEHZ-UHFFFAOYSA-N
MW292.33 g/mol
LogP2.45
Rot. Bonds6

About 2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid

2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid (PubChem CID 2348766) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is 2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid
PubChem CID2348766
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC Name2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid
SMILESCOc1ccc(NC(=O)CC2(CC(=O)O)CCCC2)cn1
InChIInChI=1S/C15H20N2O4/c1-21-13-5-4-11(10-16-13)17-12(18)8-15(9-14(19)20)6-2-3-7-15/h4-5,10H,2-3,6-9H2,1H3,(H,17,18)(H,19,20)
InChIKeyBRBUPHHFPYGEHZ-UHFFFAOYSA-N
XLogP2.45
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[[6-(4-Tert-butylphenoxy)pyridin-3-yl]amino]-5-oxopentanoic acid
CID 2814284
5-({6-[4-(Tert-butyl)phenoxy]-3-pyridinyl}amino)-3,3-dimethyl-5-oxopentanoic acid
CID 2814286
2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxypyridin-3-yl)acetamide
CID 4878967
2-{1-[2-Oxo-2-({6-[3-(trifluoromethyl)phenoxy]-3-pyridinyl}amino)ethyl]cyclopentyl}acetic acid
CID 2814194
2-(4-methoxyphenyl)-N-(6-methoxy-3-pyridinyl)acetamide
CID 16196883
N-(6-methoxy-3-pyridinyl)-2-phenylacetamide
CID 16196270
N-(6-methoxy-3-pyridinyl)cyclopentanecarboxamide
CID 16196312
(2S)-2-amino-N-(6-methoxy-3-pyridinyl)-4-methylpentanamide
CID 28205869
2-{[(N-(3-pyridyl)carbamoyl)methyl]cyclopentyl}acetic acid
CID 937666
3-(methoxymethyl)-N-(6-methoxy-3-pyridinyl)benzamide
CID 9210882
2-[1-[2-[(4-Methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid
CID 45268074
(3S)-3-{[(tert-butoxy)carbonyl]amino}-3-(6-methoxypyridin-3-yl)propanoic acid
CID 7016833

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid (CID 2348766) is 2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid is COc1ccc(NC(=O)CC2(CC(=O)O)CCCC2)cn1.
What is the InChIKey of 2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid?
The InChIKey is BRBUPHHFPYGEHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-21-13-5-4-11(10-16-13)17-12(18)8-15(9-14(19)20)6-2-3-7-15/h4-5,10H,2-3,6-9H2,1H3,(H,17,18)(H,19,20).
What are the key properties of 2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid?
2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid has a molecular weight of 292.33 g/mol, XLogP of 2.45, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid is sourced from PubChem (CID 2348766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).