N-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide

C20H23N5O3 — CID 46286550

IUPACN-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide
SMILESCOc1cc(NC(=O)N2CCC(n3cnc4cccnc43)CC2)cc(OC)c1
InChIInChI=1S/C20H23N5O3/c1-27-16-10-14(11-17(12-16)28-2)23-20(26)24-8-5-15(6-9-24)25-13-22-18-4-3-7-21-19(18)25/h3-4,7,10-13,15H,5-6,8-9H2,1-2H3,(H,23,26)
InChIKeyIZJBKJQVUHMHKE-UHFFFAOYSA-N
MW381.44 g/mol
LogP3.32
Rot. Bonds4

About N-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide

N-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide (PubChem CID 46286550) has the molecular formula C20H23N5O3 and a molecular weight of 381.44 g/mol. Its IUPAC name is N-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide
PubChem CID46286550
Molecular FormulaC20H23N5O3
Molecular Weight381.44 g/mol
Exact Mass381.18
IUPAC NameN-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide
SMILESCOc1cc(NC(=O)N2CCC(n3cnc4cccnc43)CC2)cc(OC)c1
InChIInChI=1S/C20H23N5O3/c1-27-16-10-14(11-17(12-16)28-2)23-20(26)24-8-5-15(6-9-24)25-13-22-18-4-3-7-21-19(18)25/h3-4,7,10-13,15H,5-6,8-9H2,1-2H3,(H,23,26)
InChIKeyIZJBKJQVUHMHKE-UHFFFAOYSA-N
XLogP3.32
TPSA81.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.44
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3,5-dimethoxyphenyl)-4-[2-(trifluoromethyl)imidazo[4,5-b]pyridin-3-yl]piperidine-1-carboxamide
CID 46286626
N-(2,3-dimethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide
CID 46286518
N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide
CID 46286530
N-(3,5-dimethoxyphenyl)-4-(4-methyl-3-oxopyrido[2,3-b]pyrazin-2-yl)piperazine-1-carboxamide
CID 83274079
tert-butyl 4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxylate
CID 11255100
N-(4-methoxyphenyl)-3-[2-(4-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]pyrrolidine-1-carboxamide
CID 87050875
4-(6-chloro-4-oxoquinazolin-3-yl)-N-(4-methoxyphenyl)piperidine-1-carboxamide
CID 50828339
N-(3,5-dimethoxyphenyl)pyrrolidine-1-carboxamide
CID 47162141
3-(1,3-benzoxazol-2-yl)-N-(3,5-dimethoxyphenyl)pyrrolidine-1-carboxamide
CID 75131700
4-cyclopentyl-N-(3,5-dimethoxyphenyl)piperazine-1-carboxamide
CID 86986929
N-(3,5-dimethoxyphenyl)-4-(1-methylbenzimidazol-2-yl)piperazine-1-carboxamide
CID 46375501
N-(3,5-dimethoxyphenyl)-3-(pyrimidin-2-ylamino)azetidine-1-carboxamide
CID 121187588

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide?
The IUPAC name of N-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide (CID 46286550) is N-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide.
What is the SMILES notation for N-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide?
The canonical SMILES for N-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide is COc1cc(NC(=O)N2CCC(n3cnc4cccnc43)CC2)cc(OC)c1.
What is the InChIKey of N-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide?
The InChIKey is IZJBKJQVUHMHKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O3/c1-27-16-10-14(11-17(12-16)28-2)23-20(26)24-8-5-15(6-9-24)25-13-22-18-4-3-7-21-19(18)25/h3-4,7,10-13,15H,5-6,8-9H2,1-2H3,(H,23,26).
What are the key properties of N-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide?
N-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide has a molecular weight of 381.44 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide is sourced from PubChem (CID 46286550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).