2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid

C18H24N2O4 — CID 166317595

IUPAC2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid
SMILESCOc1cccnc1C(=O)N1CCC(C2CCCC2C(=O)O)CC1
InChIInChI=1S/C18H24N2O4/c1-24-15-6-3-9-19-16(15)17(21)20-10-7-12(8-11-20)13-4-2-5-14(13)18(22)23/h3,6,9,12-14H,2,4-5,7-8,10-11H2,1H3,(H,22,23)
InChIKeyWNGKFIKCEZLBHA-UHFFFAOYSA-N
MW332.40 g/mol
LogP2.44
Rot. Bonds4

About 2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid

2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid (PubChem CID 166317595) has the molecular formula C18H24N2O4 and a molecular weight of 332.40 g/mol. Its IUPAC name is 2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid
PubChem CID166317595
Molecular FormulaC18H24N2O4
Molecular Weight332.40 g/mol
Exact Mass332.17
IUPAC Name2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid
SMILESCOc1cccnc1C(=O)N1CCC(C2CCCC2C(=O)O)CC1
InChIInChI=1S/C18H24N2O4/c1-24-15-6-3-9-19-16(15)17(21)20-10-7-12(8-11-20)13-4-2-5-14(13)18(22)23/h3,6,9,12-14H,2,4-5,7-8,10-11H2,1H3,(H,22,23)
InChIKeyWNGKFIKCEZLBHA-UHFFFAOYSA-N
XLogP2.44
TPSA79.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]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

1-(3-propan-2-yloxypyridine-2-carbonyl)piperidine-4-carboxylic acid
CID 119349625
N-cyclopropyl-1-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]piperidine-3-carboxamide
CID 56870281
1-cyclohexyl-4-(3-methoxypyridine-2-carbonyl)piperazin-2-one
CID 56918809
(3R,4R)-4-cyclopropyl-1-(3-prop-2-enoxypyridine-2-carbonyl)pyrrolidine-3-carboxylic acid
CID 120978547
2-(3-methoxy-2-pyridinyl)cycloheptane-1-carboxylic acid
CID 114054225
(3-ethoxy-2-pyridinyl)-[4-(N-methylanilino)piperidin-1-yl]methanone
CID 71979487
2-(4-methylazepane-1-carbonyl)pyridine-3-carboxylic acid
CID 63622054
[(3S)-4-(cyclopropylmethyl)-3-propan-2-yl-1,4-diazepan-1-yl]-(3-methoxy-2-pyridinyl)methanone
CID 95557861
[2-[4-(2-methoxyphenyl)piperidin-1-yl]-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 134700249
(3-ethoxy-2-pyridinyl)-(4-phenylmethoxypiperidin-1-yl)methanone
CID 71863399
(3S,4S)-4-cyclopropyl-1-[3-(piperidine-1-carbonyl)-2-pyridinyl]pyrrolidine-3-carboxylic acid
CID 86283173
(2R,3R)-1-(3-hydroxypyridine-2-carbonyl)-2-methylpiperidine-3-carboxylic acid
CID 122116626

Frequently Asked Questions

What is the IUPAC name of 2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid?
The IUPAC name of 2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid (CID 166317595) is 2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid is COc1cccnc1C(=O)N1CCC(C2CCCC2C(=O)O)CC1.
What is the InChIKey of 2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid?
The InChIKey is WNGKFIKCEZLBHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O4/c1-24-15-6-3-9-19-16(15)17(21)20-10-7-12(8-11-20)13-4-2-5-14(13)18(22)23/h3,6,9,12-14H,2,4-5,7-8,10-11H2,1H3,(H,22,23).
What are the key properties of 2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid?
2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid has a molecular weight of 332.40 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(3-methoxypyridine-2-carbonyl)piperidin-4-yl]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 166317595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).