N-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide

C14H17N3O — CID 171776830

IUPACN-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide
SMILESO=C(NC1CC1)c1ccc(C2=CCNCC2)cn1
InChIInChI=1S/C14H17N3O/c18-14(17-12-2-3-12)13-4-1-11(9-16-13)10-5-7-15-8-6-10/h1,4-5,9,12,15H,2-3,6-8H2,(H,17,18)
InChIKeyRBBQMTJKEMKBRP-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.35
Rot. Bonds3

About N-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide

N-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide (PubChem CID 171776830) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide
PubChem CID171776830
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide
SMILESO=C(NC1CC1)c1ccc(C2=CCNCC2)cn1
InChIInChI=1S/C14H17N3O/c18-14(17-12-2-3-12)13-4-1-11(9-16-13)10-5-7-15-8-6-10/h1,4-5,9,12,15H,2-3,6-8H2,(H,17,18)
InChIKeyRBBQMTJKEMKBRP-UHFFFAOYSA-N
XLogP1.35
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-5-(3-methyl-1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide
CID 171776824
5-(1H-pyrazol-4-yl)-N-pyrrolidin-3-ylpyridine-2-carboxamide
CID 166250475
N-cyclobutyl-5-methylpyridine-2-carboxamide
CID 170056265
2-N,5-N-dicyclohexylpyridine-2,5-dicarboxamide
CID 5195107
N-cyclopropyl-5-[6-[2-(trifluoromethyl)benzoyl]-3-pyridinyl]pyridine-2-carboxamide
CID 69397773
5-(cyclohexylamino)-N-cyclopropylpyridine-2-carboxamide
CID 109179840
N-cyclopropyl-5-ethylpyridine-2-carboxamide;ethane
CID 166088952
N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide
CID 109195297
5-(4-acetamidoanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109183029
N-cyclopropyl-5-[4-(dimethylamino)anilino]pyridine-2-carboxamide
CID 109179984
4-[(5-bromopyridine-2-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 62958596
N-[4-(pyridine-2-carbonylamino)cyclohexyl]pyridine-2-carboxamide
CID 167956409

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide?
The IUPAC name of N-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide (CID 171776830) is N-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide is O=C(NC1CC1)c1ccc(C2=CCNCC2)cn1.
What is the InChIKey of N-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide?
The InChIKey is RBBQMTJKEMKBRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c18-14(17-12-2-3-12)13-4-1-11(9-16-13)10-5-7-15-8-6-10/h1,4-5,9,12,15H,2-3,6-8H2,(H,17,18).
What are the key properties of N-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide?
N-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide has a molecular weight of 243.31 g/mol, XLogP of 1.35, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-(1,2,3,6-tetrahydropyridin-4-yl)pyridine-2-carboxamide is sourced from PubChem (CID 171776830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).