N-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide

C21H19ClN4O — CID 168930712

IUPACN-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide
SMILESCc1ncc(-c2cc(NC(=O)c3ccnc(C4CC4)c3)cnc2C)cc1Cl
InChIInChI=1S/C21H19ClN4O/c1-12-18(16-7-19(22)13(2)24-10-16)9-17(11-25-12)26-21(27)15-5-6-23-20(8-15)14-3-4-14/h5-11,14H,3-4H2,1-2H3,(H,26,27)
InChIKeyVDJLRTHWRPWOSR-UHFFFAOYSA-N
MW378.86 g/mol
LogP4.94
Rot. Bonds4

About N-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide

N-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide (PubChem CID 168930712) has the molecular formula C21H19ClN4O and a molecular weight of 378.86 g/mol. Its IUPAC name is N-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide
PubChem CID168930712
Molecular FormulaC21H19ClN4O
Molecular Weight378.86 g/mol
Exact Mass378.12
IUPAC NameN-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide
SMILESCc1ncc(-c2cc(NC(=O)c3ccnc(C4CC4)c3)cnc2C)cc1Cl
InChIInChI=1S/C21H19ClN4O/c1-12-18(16-7-19(22)13(2)24-10-16)9-17(11-25-12)26-21(27)15-5-6-23-20(8-15)14-3-4-14/h5-11,14H,3-4H2,1-2H3,(H,26,27)
InChIKeyVDJLRTHWRPWOSR-UHFFFAOYSA-N
XLogP4.94
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.86
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-cyclopropyl-N-[6-methyl-5-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-pyridinyl]pyridine-4-carboxamide
CID 169024758
N-[5-[5-cyano-6-(3-methyl-3-nitrosoazetidin-1-yl)-3-pyridinyl]-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide
CID 155216301
2-cyclopropyl-N-[5-(6-methoxy-5-morpholin-4-ylpyridazin-3-yl)-6-methyl-3-pyridinyl]pyridine-4-carboxamide
CID 90460391
N-[5-(5-cyano-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide
CID 130417877
2-cyclopropyl-N-[4-methyl-3-(2-methyl-6-morpholin-4-yl-4-pyridinyl)phenyl]pyridine-4-carboxamide
CID 134380057
N-[5-[5-cyano-6-[[(3R)-oxolan-3-yl]amino]-3-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-cyanopropan-2-yl)pyridine-4-carboxamide
CID 130417974
N-[5-[5-(3-fluorooxetan-3-yl)-6-methoxy-3-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide
CID 134609346
2-(cyclopropanecarbonylamino)-N-(6-fluoro-5-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 118071000
4-N-(3-chloro-4-methylphenyl)-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080961
N-[5-(7-ethyl-6-oxo-1,2,4,5,5a,11b-hexahydrooxepino[4,5-c][1,8]naphthyridin-10-yl)-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide
CID 139393813
2-(2-cyanopropan-2-yl)-N-[5-[6-(dimethylamino)-3-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide
CID 155216263
4-N-[5-(5-chloro-2-fluorophenyl)-3-pyridinyl]-2-N-cyclopropylpyridine-2,4-dicarboxamide
CID 141452915

Frequently Asked Questions

What is the IUPAC name of N-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide?
The IUPAC name of N-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide (CID 168930712) is N-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide.
What is the SMILES notation for N-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide?
The canonical SMILES for N-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide is Cc1ncc(-c2cc(NC(=O)c3ccnc(C4CC4)c3)cnc2C)cc1Cl.
What is the InChIKey of N-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide?
The InChIKey is VDJLRTHWRPWOSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19ClN4O/c1-12-18(16-7-19(22)13(2)24-10-16)9-17(11-25-12)26-21(27)15-5-6-23-20(8-15)14-3-4-14/h5-11,14H,3-4H2,1-2H3,(H,26,27).
What are the key properties of N-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide?
N-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide has a molecular weight of 378.86 g/mol, XLogP of 4.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(5-chloro-6-methyl-3-pyridinyl)-6-methyl-3-pyridinyl]-2-cyclopropylpyridine-4-carboxamide is sourced from PubChem (CID 168930712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).