N-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide

C9H12N6O — CID 103510347

IUPACN-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide
SMILESCn1cncc1C(=O)Nc1c(N)cnn1C
InChIInChI=1S/C9H12N6O/c1-14-5-11-4-7(14)9(16)13-8-6(10)3-12-15(8)2/h3-5H,10H2,1-2H3,(H,13,16)
InChIKeyBJTQDCBZBQDJOO-UHFFFAOYSA-N
MW220.24 g/mol
LogP-0.01
Rot. Bonds2

About N-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide

N-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide (PubChem CID 103510347) has the molecular formula C9H12N6O and a molecular weight of 220.24 g/mol. Its IUPAC name is N-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide
PubChem CID103510347
Molecular FormulaC9H12N6O
Molecular Weight220.24 g/mol
Exact Mass220.11
IUPAC NameN-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide
SMILESCn1cncc1C(=O)Nc1c(N)cnn1C
InChIInChI=1S/C9H12N6O/c1-14-5-11-4-7(14)9(16)13-8-6(10)3-12-15(8)2/h3-5H,10H2,1-2H3,(H,13,16)
InChIKeyBJTQDCBZBQDJOO-UHFFFAOYSA-N
XLogP-0.01
TPSA90.76 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.24
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-amino-1-methylpyrazol-5-yl)-5-fluoropyridine-3-carboxamide
CID 113452799
N-(4-amino-1-methylpyrazol-5-yl)-3-methyl-2-propan-2-ylbutanamide
CID 114282144
N-[4-amino-3-(trifluoromethyl)phenyl]-3-methylimidazole-4-carboxamide
CID 103510258
3-methyl-N-(2,4,6-trimethylphenyl)imidazole-4-carboxamide
CID 110858219
N-(6-amino-1,3-benzothiazol-2-yl)-3-methylimidazole-4-carboxamide
CID 103510257
N-(4-amino-1-methylpyrazol-5-yl)-5-fluoro-2-hydroxybenzamide
CID 115298387
N-(2,6-dichlorophenyl)-3-methylimidazole-4-carboxamide
CID 110864315
5-[(3-methylimidazole-4-carbonyl)amino]benzene-1,3-dicarboxylic acid
CID 103510438
3-methyl-N-[2-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]imidazole-4-carboxamide
CID 171679215
N-[4-(aminomethyl)-1-methylpyrazol-3-yl]-3-methylimidazole-4-carboxamide
CID 103510244
N-(2-methoxyethoxy)-3-methylimidazole-4-carboxamide
CID 103511267
N-[4-(hydroxymethyl)phenyl]-3-methylimidazole-4-carboxamide
CID 103511331

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide?
The IUPAC name of N-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide (CID 103510347) is N-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide.
What is the SMILES notation for N-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide?
The canonical SMILES for N-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide is Cn1cncc1C(=O)Nc1c(N)cnn1C.
What is the InChIKey of N-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide?
The InChIKey is BJTQDCBZBQDJOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N6O/c1-14-5-11-4-7(14)9(16)13-8-6(10)3-12-15(8)2/h3-5H,10H2,1-2H3,(H,13,16).
What are the key properties of N-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide?
N-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide has a molecular weight of 220.24 g/mol, XLogP of -0.01, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-1-methylpyrazol-5-yl)-3-methylimidazole-4-carboxamide is sourced from PubChem (CID 103510347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).