1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine

C10H17N3 — CID 84768012

IUPAC1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine
SMILESCNCc1ccnn1CC1CCC1
InChIInChI=1S/C10H17N3/c1-11-7-10-5-6-12-13(10)8-9-3-2-4-9/h5-6,9,11H,2-4,7-8H2,1H3
InChIKeyONZMTTHRECHZBL-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.40
Rot. Bonds4

About 1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine

1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine (PubChem CID 84768012) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine
PubChem CID84768012
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine
SMILESCNCc1ccnn1CC1CCC1
InChIInChI=1S/C10H17N3/c1-11-7-10-5-6-12-13(10)8-9-3-2-4-9/h5-6,9,11H,2-4,7-8H2,1H3
InChIKeyONZMTTHRECHZBL-UHFFFAOYSA-N
XLogP1.40
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[(5,5-dimethyloxolan-2-yl)methyl]pyrazol-3-yl]-N-methylmethanamine
CID 116524233
1-(cyclobutylmethyl)-5-(pyrrolidin-3-ylmethyl)pyrazole
CID 84685100
2-(3-bicyclo[3.1.0]hexanyl)-2-[[2-(cyclobutylmethyl)pyrazol-3-yl]methylamino]acetic acid
CID 155958394
2-[2-(cyclopropylmethyl)pyrazol-3-yl]ethanamine
CID 84652253
2-(cyclopropylmethyl)-N-propan-2-ylpyrazol-3-amine
CID 115921793
N-methyl-1-[2-[2-(2-methylpyrazol-3-yl)ethyl]pyrazol-3-yl]methanamine
CID 103015761
1-[1-(cyclobutylmethyl)tetrazol-5-yl]-N-methylmethanamine
CID 62735754
1-cyclopropyl-N-[(2-ethylpyrazol-3-yl)methyl]methanamine
CID 115761680
1-(cyclobutylmethyl)-5-pyrrolidin-2-ylpyrazole
CID 84778724
2-[[2-(cyclopropylmethyl)pyrazol-3-yl]methyl]piperidine
CID 84685102
2-[2-(cyclobutylmethyl)pyrazol-3-yl]piperidine
CID 84787046
N-cyclopentyl-2-(cyclopropylmethyl)pyrazol-3-amine
CID 115702987

Frequently Asked Questions

What is the IUPAC name of 1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine (CID 84768012) is 1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine is CNCc1ccnn1CC1CCC1.
What is the InChIKey of 1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine?
The InChIKey is ONZMTTHRECHZBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-11-7-10-5-6-12-13(10)8-9-3-2-4-9/h5-6,9,11H,2-4,7-8H2,1H3.
What are the key properties of 1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine?
1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine has a molecular weight of 179.27 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(cyclobutylmethyl)pyrazol-3-yl]-N-methylmethanamine is sourced from PubChem (CID 84768012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).