N-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide

C10H12ClN3O — CID 103886210

IUPACN-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide
SMILESO=C(Nc1ncccc1Cl)N1CCCC1
InChIInChI=1S/C10H12ClN3O/c11-8-4-3-5-12-9(8)13-10(15)14-6-1-2-7-14/h3-5H,1-2,6-7H2,(H,12,13,15)
InChIKeyNLZLUZLNUMRQHG-UHFFFAOYSA-N
MW225.68 g/mol
LogP2.36
Rot. Bonds1

About N-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide

N-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide (PubChem CID 103886210) has the molecular formula C10H12ClN3O and a molecular weight of 225.68 g/mol. Its IUPAC name is N-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide
PubChem CID103886210
Molecular FormulaC10H12ClN3O
Molecular Weight225.68 g/mol
Exact Mass225.07
IUPAC NameN-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide
SMILESO=C(Nc1ncccc1Cl)N1CCCC1
InChIInChI=1S/C10H12ClN3O/c11-8-4-3-5-12-9(8)13-10(15)14-6-1-2-7-14/h3-5H,1-2,6-7H2,(H,12,13,15)
InChIKeyNLZLUZLNUMRQHG-UHFFFAOYSA-N
XLogP2.36
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.68
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(piperidine-1-carbonylamino)pyridine-3-carboxylic acid
CID 79155083
N-(5-chloroquinolin-8-yl)piperidine-1-carboxamide
CID 116783798
methyl N-(3-chloro-2-pyridinyl)carbamate
CID 103094493
1-(3-chloro-2-pyridinyl)-3-propan-2-ylurea
CID 103886204
N-(3-methyl-2-pyridinyl)morpholine-4-carboxamide
CID 3411498
N-(3-amino-2-pyridinyl)-3-methylpiperidine-1-carboxamide
CID 113391868
2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide
CID 103892911
4-[(3-chloro-2-pyridinyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 103094698
N-(3-chloro-2-pyridinyl)-2-phenylacetamide
CID 903998
5-chloro-N-(3-chloro-2-pyridinyl)-1,3,4-thiadiazole-2-carboxamide
CID 103094101
N-(3-chloro-2-pyridinyl)-2-phenylsulfanylacetamide
CID 103893032
2-[(3-chloro-2-pyridinyl)carbamoylamino]acetic acid
CID 103094708

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide (CID 103886210) is N-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide is O=C(Nc1ncccc1Cl)N1CCCC1.
What is the InChIKey of N-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide?
The InChIKey is NLZLUZLNUMRQHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN3O/c11-8-4-3-5-12-9(8)13-10(15)14-6-1-2-7-14/h3-5H,1-2,6-7H2,(H,12,13,15).
What are the key properties of N-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide?
N-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide has a molecular weight of 225.68 g/mol, XLogP of 2.36, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-pyridinyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 103886210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).