3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide

C22H18N6O — CID 151947984

IUPAC3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide
SMILESCN(C(=O)c1ccn2ncc(-c3ccc(CN)cn3)c2c1)c1ccc(C#N)cc1
InChIInChI=1S/C22H18N6O/c1-27(18-5-2-15(11-23)3-6-18)22(29)17-8-9-28-21(10-17)19(14-26-28)20-7-4-16(12-24)13-25-20/h2-10,13-14H,12,24H2,1H3
InChIKeyTWARZFYQSUCWHT-UHFFFAOYSA-N
MW382.43 g/mol
LogP3.00
Rot. Bonds4

About 3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide

3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide (PubChem CID 151947984) has the molecular formula C22H18N6O and a molecular weight of 382.43 g/mol. Its IUPAC name is 3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide.

Molecular Properties

Compound Name3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide
PubChem CID151947984
Molecular FormulaC22H18N6O
Molecular Weight382.43 g/mol
Exact Mass382.15
IUPAC Name3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide
SMILESCN(C(=O)c1ccn2ncc(-c3ccc(CN)cn3)c2c1)c1ccc(C#N)cc1
InChIInChI=1S/C22H18N6O/c1-27(18-5-2-15(11-23)3-6-18)22(29)17-8-9-28-21(10-17)19(14-26-28)20-7-4-16(12-24)13-25-20/h2-10,13-14H,12,24H2,1H3
InChIKeyTWARZFYQSUCWHT-UHFFFAOYSA-N
XLogP3.00
TPSA100.31 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.43
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(5-amino-6-chloro-3-pyridinyl)-N-(5-cyano-2-pyridinyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide
CID 90157076
3-[4-(2-aminopropanoylamino)cyclohexa-2,4-dien-1-yl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide
CID 144630321
3-(6-carbamoyl-3-pyridinyl)-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide
CID 90157223
N-[4-(aminomethyl)phenyl]-N-methyl-6-pyridin-2-ylpyridine-3-carboxamide
CID 166362090
6-bromo-N-(4-cyanophenyl)-N-methylpyridine-3-carboxamide
CID 66463352
3-bromo-N-(5-cyano-2-pyridinyl)-N-propan-2-ylpyrazolo[1,5-a]pyridine-5-carboxamide;6-bromo-N-methylpyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-3-[5-(methylcarbamoyl)-2-pyridinyl]-N-propan-2-ylpyrazolo[1,5-a]pyridine-5-carboxamide;methane;N-methyl-6-trimethylstannylpyridine-3-carboxamide
CID 161322259
N-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide
CID 90157612
ethyl 5-[[3-(4-carbamoylphenyl)pyrazolo[1,5-a]pyridine-5-carbonyl]-methylamino]-2-chlorobenzoate
CID 163255398
N-(4-cyanophenyl)-N-methylpyridazine-4-carboxamide
CID 104670312
3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide
CID 62981026
N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide
CID 113242357
tert-butyl N-(N-(3-bromopyrazolo[1,5-a]pyridine-5-carbonyl)-4-cyanoanilino)-N-methylcarbamate
CID 90175920

Frequently Asked Questions

What is the IUPAC name of 3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide?
The IUPAC name of 3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide (CID 151947984) is 3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide.
What is the SMILES notation for 3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide?
The canonical SMILES for 3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide is CN(C(=O)c1ccn2ncc(-c3ccc(CN)cn3)c2c1)c1ccc(C#N)cc1.
What is the InChIKey of 3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide?
The InChIKey is TWARZFYQSUCWHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N6O/c1-27(18-5-2-15(11-23)3-6-18)22(29)17-8-9-28-21(10-17)19(14-26-28)20-7-4-16(12-24)13-25-20/h2-10,13-14H,12,24H2,1H3.
What are the key properties of 3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide?
3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide has a molecular weight of 382.43 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(aminomethyl)-2-pyridinyl]-N-(4-cyanophenyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide is sourced from PubChem (CID 151947984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).