N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide

C19H26N4O — CID 164736662

IUPACN-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide
SMILESCc1c(NC(=O)c2nc3c(n2C)CCNC3)cccc1C(C)(C)C
InChIInChI=1S/C19H26N4O/c1-12-13(19(2,3)4)7-6-8-14(12)22-18(24)17-21-15-11-20-10-9-16(15)23(17)5/h6-8,20H,9-11H2,1-5H3,(H,22,24)
InChIKeyDKCSCZBQRBJANE-UHFFFAOYSA-N
MW326.44 g/mol
LogP2.92
Rot. Bonds2

About N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide

N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide (PubChem CID 164736662) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide
PubChem CID164736662
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC NameN-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide
SMILESCc1c(NC(=O)c2nc3c(n2C)CCNC3)cccc1C(C)(C)C
InChIInChI=1S/C19H26N4O/c1-12-13(19(2,3)4)7-6-8-14(12)22-18(24)17-21-15-11-20-10-9-16(15)23(17)5/h6-8,20H,9-11H2,1-5H3,(H,22,24)
InChIKeyDKCSCZBQRBJANE-UHFFFAOYSA-N
XLogP2.92
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide with MolForge

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Related Compounds

1-methyl-N-(2-methyl-3-propan-2-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide
CID 167001250
N-[3-[2-chloro-3-[(1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carbonyl)amino]phenyl]-2-methylphenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide
CID 135165143
tert-butyl 2-[2-[2-chloro-3-[2-methyl-3-[(1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carbonyl)amino]phenyl]phenyl]acetyl]-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxylate
CID 160782425
4-[2-[[2-chloro-3-[2-methyl-3-[(1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carbonyl)amino]phenyl]anilino]-hydroxymethyl]-3-methyl-4,5,6,7,8,9-hexahydrocycloocta[d]imidazol-6-yl]-1-methylcyclohexane-1-carboxylic acid
CID 170080292
N-[3-(3-formamido-2-methylphenyl)-2-methylphenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide
CID 156575281
methyl 4-[2-[2-[[2-chloro-3-[2-chloro-3-[(1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carbonyl)amino]phenyl]phenyl]carbamoyl]-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl]ethyl]bicyclo[2.2.1]heptane-1-carboxylate
CID 146234785
methyl 1-[[8-[[2-chloro-3-[2-methyl-3-[(1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carbonyl)amino]phenyl]phenyl]methyl]-1,7-naphthyridin-3-yl]methyl]azetidine-3-carboxylate
CID 161109678
N-[2-chloro-3-[3-[7-cyano-5-(pyrrolidin-1-ylmethyl)-1,3-benzoxazol-2-yl]-2-methylphenyl]phenyl]-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide
CID 135176309
1-methyl-N-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 82585546
4-[2-[2-[[2-chloro-3-[2-chloro-3-[2-(1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-2-oxoethyl]phenyl]phenyl]carbamoyl]-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl]ethyl]bicyclo[2.2.1]heptane-1-carboxylic acid
CID 160746083
(4-tert-butyl-2,3-dihydroindol-1-yl)-pyridin-2-ylmethanone;(4-tert-butyl-2,3-dihydroindol-1-yl)-(1,3-thiazol-2-yl)methanone;4-tert-butyl-1-methylindazole;4-[3-(3-tert-butyl-2-methylphenoxy)propyl]morpholine;N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide;N-(3-tert-butyl-2-methylphenyl)-3-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide;5-(3-tert-butyl-2-methylphenyl)pyrido[3,4-b]pyrazine;N-(3-tert-butyl-2-methylphenyl)-1,3-thiazole-2-carboxamide
CID 165023850
methyl 4-[2-[2-[[2-chloro-3-[2-chloro-3-[2-(1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl)-2-oxoethyl]phenyl]phenyl]carbamoyl]-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl]ethyl]bicyclo[2.2.1]heptane-1-carboxylate
CID 159469152

Frequently Asked Questions

What is the IUPAC name of N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide?
The IUPAC name of N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide (CID 164736662) is N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide.
What is the SMILES notation for N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide?
The canonical SMILES for N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide is Cc1c(NC(=O)c2nc3c(n2C)CCNC3)cccc1C(C)(C)C.
What is the InChIKey of N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide?
The InChIKey is DKCSCZBQRBJANE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c1-12-13(19(2,3)4)7-6-8-14(12)22-18(24)17-21-15-11-20-10-9-16(15)23(17)5/h6-8,20H,9-11H2,1-5H3,(H,22,24).
What are the key properties of N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide?
N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide has a molecular weight of 326.44 g/mol, XLogP of 2.92, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide is sourced from PubChem (CID 164736662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).