1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide

C10H16N4O — CID 82873363

IUPAC1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide
SMILESCn1ccc(CNC(=O)C2(N)CCC2)n1
InChIInChI=1S/C10H16N4O/c1-14-6-3-8(13-14)7-12-9(15)10(11)4-2-5-10/h3,6H,2,4-5,7,11H2,1H3,(H,12,15)
InChIKeyKGDYOKJWRMDAAV-UHFFFAOYSA-N
MW208.26 g/mol
LogP-0.08
Rot. Bonds3

About 1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide

1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide (PubChem CID 82873363) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide
PubChem CID82873363
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide
SMILESCn1ccc(CNC(=O)C2(N)CCC2)n1
InChIInChI=1S/C10H16N4O/c1-14-6-3-8(13-14)7-12-9(15)10(11)4-2-5-10/h3,6H,2,4-5,7,11H2,1H3,(H,12,15)
InChIKeyKGDYOKJWRMDAAV-UHFFFAOYSA-N
XLogP-0.08
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyano-N-[(1-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide
CID 82873497
1-(4-aminophenyl)-N-[(1-methylpyrazol-3-yl)methyl]cyclopropane-1-carboxamide
CID 115913896
1-amino-3-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]cyclohexane-1-carboxamide
CID 106105095
1-amino-N-[(1-methylpyrrol-2-yl)methyl]cyclobutane-1-carboxamide
CID 106416698
2-(1-aminocyclobutyl)-N-[2-(1-methylpyrazol-3-yl)ethyl]acetamide
CID 106104898
6-amino-7,7-dimethyl-N-[(1-methylpyrazol-3-yl)methyl]-2-oxabicyclo[3.2.0]heptane-6-carboxamide
CID 114946520
2-(aminomethyl)-N-[(1-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide
CID 82873603
2,2-dimethyl-N-[(1-methylpyrazol-3-yl)methyl]propanamide
CID 82874484
2-[(1-methylpyrazol-3-yl)methylamino]-1-piperidin-1-ylethanone
CID 78921060
4-[(1-methylpyrazol-3-yl)methylcarbamoylamino]-4-oxobutanoic acid
CID 82873391
2-[(1-methylpyrazol-3-yl)methylcarbamoylamino]cycloheptane-1-carboxylic acid
CID 82873513
(2S)-2-amino-3-methyl-N-[(1-methylpyrazol-3-yl)methyl]butanamide
CID 82882870

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide?
The IUPAC name of 1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide (CID 82873363) is 1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide?
The canonical SMILES for 1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide is Cn1ccc(CNC(=O)C2(N)CCC2)n1.
What is the InChIKey of 1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide?
The InChIKey is KGDYOKJWRMDAAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-14-6-3-8(13-14)7-12-9(15)10(11)4-2-5-10/h3,6H,2,4-5,7,11H2,1H3,(H,12,15).
What are the key properties of 1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide?
1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide has a molecular weight of 208.26 g/mol, XLogP of -0.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide is sourced from PubChem (CID 82873363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).