N-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide

C14H13N5O — CID 123833221

IUPACN-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide
SMILESCC(=O)Nc1ccc(Nc2n[nH]c3cccnc23)cc1
InChIInChI=1S/C14H13N5O/c1-9(20)16-10-4-6-11(7-5-10)17-14-13-12(18-19-14)3-2-8-15-13/h2-8H,1H3,(H,16,20)(H2,17,18,19)
InChIKeyPGUBPTGWGVOJTN-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.66
Rot. Bonds3

About N-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide

N-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide (PubChem CID 123833221) has the molecular formula C14H13N5O and a molecular weight of 267.29 g/mol. Its IUPAC name is N-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide
PubChem CID123833221
Molecular FormulaC14H13N5O
Molecular Weight267.29 g/mol
Exact Mass267.11
IUPAC NameN-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide
SMILESCC(=O)Nc1ccc(Nc2n[nH]c3cccnc23)cc1
InChIInChI=1S/C14H13N5O/c1-9(20)16-10-4-6-11(7-5-10)17-14-13-12(18-19-14)3-2-8-15-13/h2-8H,1H3,(H,16,20)(H2,17,18,19)
InChIKeyPGUBPTGWGVOJTN-UHFFFAOYSA-N
XLogP2.66
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,6-dimethylphenyl)-4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)benzenesulfonamide
CID 71526403
1-(4-fluoro-3-methylphenyl)-3-(1H-pyrazolo[4,3-b]pyridin-3-yl)urea
CID 53373996
N-[4-(pyrimidin-2-ylamino)phenyl]acetamide
CID 123760459
N-(3-propan-2-yl-1-benzofuran-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 134190101
N-(1-methylindazol-5-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 134198363
1-chloro-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine
CID 134191539
N-(3-chloro-4-pyrimidin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 53373665
2-chloro-4-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1-N-pyridin-2-ylbenzene-1,4-diamine
CID 118311727
N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-2-pyrimidin-5-ylacetamide
CID 167874851
N-[3-fluoro-5-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 53374209
N-[3-[dideuterio(fluoro)methyl]sulfanyl-4-fluorophenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 164738398
N-[4-methyl-3-[(Z)-3-methyl-2-(methylideneamino)but-1-enyl]phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 134197885

Frequently Asked Questions

What is the IUPAC name of N-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide?
The IUPAC name of N-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide (CID 123833221) is N-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide.
What is the SMILES notation for N-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide?
The canonical SMILES for N-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide is CC(=O)Nc1ccc(Nc2n[nH]c3cccnc23)cc1.
What is the InChIKey of N-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide?
The InChIKey is PGUBPTGWGVOJTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O/c1-9(20)16-10-4-6-11(7-5-10)17-14-13-12(18-19-14)3-2-8-15-13/h2-8H,1H3,(H,16,20)(H2,17,18,19).
What are the key properties of N-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide?
N-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide has a molecular weight of 267.29 g/mol, XLogP of 2.66, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)phenyl]acetamide is sourced from PubChem (CID 123833221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).