6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide

C16H17N3O — CID 110483045

IUPAC6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)NCC2(c3cccnc3)CC2)n1
InChIInChI=1S/C16H17N3O/c1-12-4-2-6-14(19-12)15(20)18-11-16(7-8-16)13-5-3-9-17-10-13/h2-6,9-10H,7-8,11H2,1H3,(H,18,20)
InChIKeyKAOADMDGLSQDIL-UHFFFAOYSA-N
MW267.33 g/mol
LogP2.25
Rot. Bonds4

About 6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide

6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide (PubChem CID 110483045) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is 6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide
PubChem CID110483045
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)NCC2(c3cccnc3)CC2)n1
InChIInChI=1S/C16H17N3O/c1-12-4-2-6-14(19-12)15(20)18-11-16(7-8-16)13-5-3-9-17-10-13/h2-6,9-10H,7-8,11H2,1H3,(H,18,20)
InChIKeyKAOADMDGLSQDIL-UHFFFAOYSA-N
XLogP2.25
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-2-carboxamide
CID 39022305
2-(dimethylamino)-N-[(1-pyridin-3-ylcyclopropyl)methyl]acetamide
CID 110479717
N-[[1-(aminomethyl)cyclopropyl]methyl]-6-methylpyridine-2-carboxamide
CID 115456878
N-[(1-aminocyclohexyl)methyl]-6-methylpyridine-2-carboxamide
CID 119404313
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-6-methylpyridine-2-carboxamide
CID 65118974
5-methyl-N-[(1-phenylcyclobutyl)methyl]pyrazine-2-carboxamide
CID 52556515
N-[[1-(4-chlorophenyl)cyclopropyl]methyl]pyridine-3-carboxamide
CID 113090713
1-[2,6-di(propan-2-yl)phenyl]-3-[(1-pyridin-3-ylcyclopentyl)methyl]urea
CID 14977528
6-methyl-N-[2-(pyrazin-2-ylamino)ethyl]pyridine-2-carboxamide
CID 38583271
6-[[1-(2-methylphenyl)cyclopropyl]methylcarbamoyl]pyridine-2-carboxylic acid
CID 119183961
N-methyl-1-(1-pyridin-3-ylcyclobutyl)methanamine
CID 80522291
N-(2-chloropropyl)-6-methylpyridine-2-carboxamide
CID 114296366

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide?
The IUPAC name of 6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide (CID 110483045) is 6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide is Cc1cccc(C(=O)NCC2(c3cccnc3)CC2)n1.
What is the InChIKey of 6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide?
The InChIKey is KAOADMDGLSQDIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-12-4-2-6-14(19-12)15(20)18-11-16(7-8-16)13-5-3-9-17-10-13/h2-6,9-10H,7-8,11H2,1H3,(H,18,20).
What are the key properties of 6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide?
6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide has a molecular weight of 267.33 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[(1-pyridin-3-ylcyclopropyl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 110483045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).