(2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide

C12H17N3O — CID 95804889

IUPAC(2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide
SMILESNC(=O)[C@@]1(CCCc2ccccn2)CCN1
InChIInChI=1S/C12H17N3O/c13-11(16)12(7-9-15-12)6-3-5-10-4-1-2-8-14-10/h1-2,4,8,15H,3,5-7,9H2,(H2,13,16)/t12-/m1/s1
InChIKeyHPNMLZLSNUWCTF-GFCCVEGCSA-N
MW219.29 g/mol
LogP0.62
Rot. Bonds5

About (2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide

(2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide (PubChem CID 95804889) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is (2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide
PubChem CID95804889
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name(2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide
SMILESNC(=O)[C@@]1(CCCc2ccccn2)CCN1
InChIInChI=1S/C12H17N3O/c13-11(16)12(7-9-15-12)6-3-5-10-4-1-2-8-14-10/h1-2,4,8,15H,3,5-7,9H2,(H2,13,16)/t12-/m1/s1
InChIKeyHPNMLZLSNUWCTF-GFCCVEGCSA-N
XLogP0.62
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-pyrimidin-4-ylpropyl)azetidine-2-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 119057190
2-(3-pyrazin-2-ylpropyl)piperidine-2-carboxamide
CID 73440335
N,N-dimethyl-4-(3-pyridin-2-ylpropyl)piperidine-4-carboxamide;dihydrochloride
CID 71298562
1-(pyridin-2-ylmethyl)-3-(3-pyridin-2-ylpropyl)piperidine-3-carboxamide
CID 110090181
(3R)-1-(2-hydroxyethyl)-3-(3-pyridin-2-ylpropyl)piperidine-3-carboxamide
CID 124946791
2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid
CID 53398196
1-[1-(2-pyridin-2-ylethyl)cyclopropyl]ethanone
CID 106796916
2-(14-pyridin-2-yltetradecyl)pyridine
CID 10594187
1-(2-pyridin-2-ylethyl)cyclopentane-1-carboxylic acid
CID 79424921
2-(3-pyridin-2-ylpropyl)benzamide
CID 173328031
1-methyl-2-(3-pyridin-2-ylpropyl)pyrrolidine-2-carboxylic acid;hydrochloride
CID 71298904
methyl N'-(3-pyridin-2-ylpropyl)carbamimidothioate
CID 14126562

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide?
The IUPAC name of (2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide (CID 95804889) is (2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide.
What is the SMILES notation for (2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide?
The canonical SMILES for (2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide is NC(=O)[C@@]1(CCCc2ccccn2)CCN1.
What is the InChIKey of (2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide?
The InChIKey is HPNMLZLSNUWCTF-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H17N3O/c13-11(16)12(7-9-15-12)6-3-5-10-4-1-2-8-14-10/h1-2,4,8,15H,3,5-7,9H2,(H2,13,16)/t12-/m1/s1.
What are the key properties of (2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide?
(2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide has a molecular weight of 219.29 g/mol, XLogP of 0.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3-pyridin-2-ylpropyl)azetidine-2-carboxamide is sourced from PubChem (CID 95804889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).