4-(pyridin-2-ylamino)piperidine-4-carboxylic acid

C11H15N3O2 — CID 131691989

IUPAC4-(pyridin-2-ylamino)piperidine-4-carboxylic acid
SMILESO=C(O)C1(Nc2ccccn2)CCNCC1
InChIInChI=1S/C11H15N3O2/c15-10(16)11(4-7-12-8-5-11)14-9-3-1-2-6-13-9/h1-3,6,12H,4-5,7-8H2,(H,13,14)(H,15,16)
InChIKeyIHOACQKRXNBNGS-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.70
Rot. Bonds3

About 4-(pyridin-2-ylamino)piperidine-4-carboxylic acid

4-(pyridin-2-ylamino)piperidine-4-carboxylic acid (PubChem CID 131691989) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 4-(pyridin-2-ylamino)piperidine-4-carboxylic acid.

Molecular Properties

Compound Name4-(pyridin-2-ylamino)piperidine-4-carboxylic acid
PubChem CID131691989
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name4-(pyridin-2-ylamino)piperidine-4-carboxylic acid
SMILESO=C(O)C1(Nc2ccccn2)CCNCC1
InChIInChI=1S/C11H15N3O2/c15-10(16)11(4-7-12-8-5-11)14-9-3-1-2-6-13-9/h1-3,6,12H,4-5,7-8H2,(H,13,14)(H,15,16)
InChIKeyIHOACQKRXNBNGS-UHFFFAOYSA-N
XLogP0.70
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methylpyrrolidin-3-yl)pyridin-2-amine
CID 107425698
1-(pyridin-2-ylcarbamoyl)cyclopropane-1-carboxylic acid
CID 62095693
1-(pyrimidin-2-ylamino)cycloheptane-1-carboxylic acid
CID 61291427
1-(hydroxymethyl)-N-pyridin-2-ylcyclopropane-1-carboxamide
CID 115182071
2-piperidin-4-yl-N-pyridin-2-ylacetamide;dihydrochloride
CID 119827189
4-methoxy-N-[3-(pyridin-2-ylcarbamoyl)phenyl]piperidine-4-carboxamide;dihydrochloride
CID 119870520
1-(pyridin-2-ylmethylamino)cyclopentane-1-carboxylic acid
CID 71565011
1-[(6-carbamoyl-2-pyridinyl)amino]cyclobutane-1-carboxylic acid
CID 81164896
3-pyridin-2-ylbicyclo[1.1.1]pentane-1-carboxylic acid;hydrochloride
CID 163342206
2-[1-piperazin-1-yl-4-[3-(pyridin-2-ylamino)propyl]cyclohexyl]acetic acid
CID 140991979
1-[(4-nitro-2-pyridinyl)amino]cyclobutane-1-carboxylic acid
CID 81164674
3-anilinopiperidine-3-carboxylic acid
CID 131691987

Frequently Asked Questions

What is the IUPAC name of 4-(pyridin-2-ylamino)piperidine-4-carboxylic acid?
The IUPAC name of 4-(pyridin-2-ylamino)piperidine-4-carboxylic acid (CID 131691989) is 4-(pyridin-2-ylamino)piperidine-4-carboxylic acid.
What is the SMILES notation for 4-(pyridin-2-ylamino)piperidine-4-carboxylic acid?
The canonical SMILES for 4-(pyridin-2-ylamino)piperidine-4-carboxylic acid is O=C(O)C1(Nc2ccccn2)CCNCC1.
What is the InChIKey of 4-(pyridin-2-ylamino)piperidine-4-carboxylic acid?
The InChIKey is IHOACQKRXNBNGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c15-10(16)11(4-7-12-8-5-11)14-9-3-1-2-6-13-9/h1-3,6,12H,4-5,7-8H2,(H,13,14)(H,15,16).
What are the key properties of 4-(pyridin-2-ylamino)piperidine-4-carboxylic acid?
4-(pyridin-2-ylamino)piperidine-4-carboxylic acid has a molecular weight of 221.26 g/mol, XLogP of 0.70, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(pyridin-2-ylamino)piperidine-4-carboxylic acid is sourced from PubChem (CID 131691989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).