5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide

C10H10ClN5O — CID 142825639

IUPAC5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide
SMILESCc1cnc(-n2ncc(C(N)=O)c2N)c(Cl)c1
InChIInChI=1S/C10H10ClN5O/c1-5-2-7(11)10(14-3-5)16-8(12)6(4-15-16)9(13)17/h2-4H,12H2,1H3,(H2,13,17)
InChIKeySHBNFBCYHNMLPG-UHFFFAOYSA-N
MW251.68 g/mol
LogP0.91
Rot. Bonds2

About 5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide

5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide (PubChem CID 142825639) has the molecular formula C10H10ClN5O and a molecular weight of 251.68 g/mol. Its IUPAC name is 5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide
PubChem CID142825639
Molecular FormulaC10H10ClN5O
Molecular Weight251.68 g/mol
Exact Mass251.06
IUPAC Name5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide
SMILESCc1cnc(-n2ncc(C(N)=O)c2N)c(Cl)c1
InChIInChI=1S/C10H10ClN5O/c1-5-2-7(11)10(14-3-5)16-8(12)6(4-15-16)9(13)17/h2-4H,12H2,1H3,(H2,13,17)
InChIKeySHBNFBCYHNMLPG-UHFFFAOYSA-N
XLogP0.91
TPSA99.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.68
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide?
The IUPAC name of 5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide (CID 142825639) is 5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide is Cc1cnc(-n2ncc(C(N)=O)c2N)c(Cl)c1.
What is the InChIKey of 5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide?
The InChIKey is SHBNFBCYHNMLPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN5O/c1-5-2-7(11)10(14-3-5)16-8(12)6(4-15-16)9(13)17/h2-4H,12H2,1H3,(H2,13,17).
What are the key properties of 5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide?
5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide has a molecular weight of 251.68 g/mol, XLogP of 0.91, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-(3-chloro-5-methyl-2-pyridinyl)pyrazole-4-carboxamide is sourced from PubChem (CID 142825639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).