5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide

C6H10N4O — CID 57073549

IUPAC5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide
SMILESCc1c(C(N)=O)n[nH]c1CN
InChIInChI=1S/C6H10N4O/c1-3-4(2-7)9-10-5(3)6(8)11/h2,7H2,1H3,(H2,8,11)(H,9,10)
InChIKeyKUDWRFJEHVRRIH-UHFFFAOYSA-N
MW154.17 g/mol
LogP-0.72
Rot. Bonds2

About 5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide

5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide (PubChem CID 57073549) has the molecular formula C6H10N4O and a molecular weight of 154.17 g/mol. Its IUPAC name is 5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide
PubChem CID57073549
Molecular FormulaC6H10N4O
Molecular Weight154.17 g/mol
Exact Mass154.09
IUPAC Name5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide
SMILESCc1c(C(N)=O)n[nH]c1CN
InChIInChI=1S/C6H10N4O/c1-3-4(2-7)9-10-5(3)6(8)11/h2,7H2,1H3,(H2,8,11)(H,9,10)
InChIKeyKUDWRFJEHVRRIH-UHFFFAOYSA-N
XLogP-0.72
TPSA97.79 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-0.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-5-ethyl-1H-pyrazole-3-carboxamide
CID 130118792
4-amino-5-(2-hydroxyethyl)-1H-pyrazole-3-carboxamide
CID 155251418
4-methyl-5-propyl-1H-pyrazole-3-carboxylic acid
CID 70208917
ethane;4-ethyl-5-propyl-1H-pyrazole-3-carboxamide;propane
CID 170574655
[4-methyl-3-(4-methylphenyl)-1H-pyrazol-5-yl]methanamine
CID 83848092
4,5-bis(3,3,3-trifluoropropyl)-1H-pyrazole-3-carboxamide
CID 141430246
ethyl 5-(4-chlorobutyl)-4-methyl-1H-pyrazole-3-carboxylate
CID 69492939
CID 175054353
CID 175054353
N-ethyl-4,5-dimethyl-1H-pyrazole-3-carboxamide
CID 126996863
5-(aminomethyl)-2-methyl-1H-imidazole-4-carboxylic acid
CID 83670470
4-methyl-1H-indazole-3-carboxamide
CID 67513423
ethane;ethyl 4,5-dimethyl-1H-pyrazole-3-carboxylate
CID 145047369

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide (CID 57073549) is 5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide is Cc1c(C(N)=O)n[nH]c1CN.
What is the InChIKey of 5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide?
The InChIKey is KUDWRFJEHVRRIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O/c1-3-4(2-7)9-10-5(3)6(8)11/h2,7H2,1H3,(H2,8,11)(H,9,10).
What are the key properties of 5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide?
5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide has a molecular weight of 154.17 g/mol, XLogP of -0.72, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-4-methyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 57073549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).