1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide

C10H16N4O — CID 80588316

IUPAC1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide
SMILESCC1CC(CN)(C(=O)Nc2cn[nH]c2)C1
InChIInChI=1S/C10H16N4O/c1-7-2-10(3-7,6-11)9(15)14-8-4-12-13-5-8/h4-5,7H,2-3,6,11H2,1H3,(H,12,13)(H,14,15)
InChIKeyHZZWTLOGVIULIH-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.72
Rot. Bonds3

About 1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide

1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide (PubChem CID 80588316) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide
PubChem CID80588316
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide
SMILESCC1CC(CN)(C(=O)Nc2cn[nH]c2)C1
InChIInChI=1S/C10H16N4O/c1-7-2-10(3-7,6-11)9(15)14-8-4-12-13-5-8/h4-5,7H,2-3,6,11H2,1H3,(H,12,13)(H,14,15)
InChIKeyHZZWTLOGVIULIH-UHFFFAOYSA-N
XLogP0.72
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-N-(1H-pyrazol-4-yl)cyclopropane-1-carboxamide
CID 80588422
1-(aminomethyl)-3-methyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclobutane-1-carboxamide
CID 106217378
4-[[1-(aminomethyl)-3-methylcyclobutanecarbonyl]amino]benzamide
CID 80588190
1-(aminomethyl)-3-methyl-N-(4-propylphenyl)cyclobutane-1-carboxamide
CID 80588204
1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide
CID 130688568
1-(aminomethyl)-3-methyl-N-(5-methyl-2-pyridinyl)cyclobutane-1-carboxamide
CID 80587423
3-propyl-N-(1H-pyrazol-4-yl)pyrrolidine-3-carboxamide
CID 63138545
1-carbamothioyl-N-(1H-pyrazol-4-yl)cyclopropane-1-carboxamide
CID 80589522
1-(1H-pyrazol-4-ylcarbamoyl)cycloheptane-1-carboxylic acid
CID 138033225
1-(aminomethyl)-N-(1,3-dimethylpyrazol-4-yl)-3-methylcyclobutane-1-carboxamide
CID 102804722
cis-(1S,2R)-2-(1H-pyrazol-4-ylcarbamoyl)cyclopropane-1-carboxylic acid
CID 93311811
3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride
CID 119944674

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide (CID 80588316) is 1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide is CC1CC(CN)(C(=O)Nc2cn[nH]c2)C1.
What is the InChIKey of 1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide?
The InChIKey is HZZWTLOGVIULIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-7-2-10(3-7,6-11)9(15)14-8-4-12-13-5-8/h4-5,7H,2-3,6,11H2,1H3,(H,12,13)(H,14,15).
What are the key properties of 1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide?
1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide has a molecular weight of 208.26 g/mol, XLogP of 0.72, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide is sourced from PubChem (CID 80588316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).