N,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide

C18H23N7O — CID 175650443

IUPACN,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide
SMILESCN(C(=O)c1cnn(C)c1)C1CCN(c2nc3cccnc3n2C)CC1
InChIInChI=1S/C18H23N7O/c1-22-12-13(11-20-22)17(26)23(2)14-6-9-25(10-7-14)18-21-15-5-4-8-19-16(15)24(18)3/h4-5,8,11-12,14H,6-7,9-10H2,1-3H3
InChIKeyKASRPACRRXVCEL-UHFFFAOYSA-N
MW353.43 g/mol
LogP1.44
Rot. Bonds3

About N,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide

N,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide (PubChem CID 175650443) has the molecular formula C18H23N7O and a molecular weight of 353.43 g/mol. Its IUPAC name is N,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide
PubChem CID175650443
Molecular FormulaC18H23N7O
Molecular Weight353.43 g/mol
Exact Mass353.20
IUPAC NameN,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide
SMILESCN(C(=O)c1cnn(C)c1)C1CCN(c2nc3cccnc3n2C)CC1
InChIInChI=1S/C18H23N7O/c1-22-12-13(11-20-22)17(26)23(2)14-6-9-25(10-7-14)18-21-15-5-4-8-19-16(15)24(18)3/h4-5,8,11-12,14H,6-7,9-10H2,1-3H3
InChIKeyKASRPACRRXVCEL-UHFFFAOYSA-N
XLogP1.44
TPSA72.08 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide?
The IUPAC name of N,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide (CID 175650443) is N,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide.
What is the SMILES notation for N,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide?
The canonical SMILES for N,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide is CN(C(=O)c1cnn(C)c1)C1CCN(c2nc3cccnc3n2C)CC1.
What is the InChIKey of N,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide?
The InChIKey is KASRPACRRXVCEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N7O/c1-22-12-13(11-20-22)17(26)23(2)14-6-9-25(10-7-14)18-21-15-5-4-8-19-16(15)24(18)3/h4-5,8,11-12,14H,6-7,9-10H2,1-3H3.
What are the key properties of N,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide?
N,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide has a molecular weight of 353.43 g/mol, XLogP of 1.44, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide is sourced from PubChem (CID 175650443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).