[3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine

C12H21N3 — CID 82871482

IUPAC[3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine
SMILESCC1CCC(CN)(Cc2ccn(C)n2)C1
InChIInChI=1S/C12H21N3/c1-10-3-5-12(7-10,9-13)8-11-4-6-15(2)14-11/h4,6,10H,3,5,7-9,13H2,1-2H3
InChIKeyFVSCAMZZOGDJME-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.73
Rot. Bonds3

About [3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine

[3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine (PubChem CID 82871482) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is [3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine.

Molecular Properties

Compound Name[3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine
PubChem CID82871482
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name[3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine
SMILESCC1CCC(CN)(Cc2ccn(C)n2)C1
InChIInChI=1S/C12H21N3/c1-10-3-5-12(7-10,9-13)8-11-4-6-15(2)14-11/h4,6,10H,3,5,7-9,13H2,1-2H3
InChIKeyFVSCAMZZOGDJME-UHFFFAOYSA-N
XLogP1.73
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[(1-methylpyrazol-3-yl)methyl]cyclobutyl]methanamine
CID 82871669
[1-[(1-methylpyrazol-3-yl)methyl]cyclooctyl]methanamine
CID 82870564
4-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclohexan-1-ol
CID 82869191
4-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclohexane-1-carboxylic acid
CID 82870688
4-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclohexane-1-carbonitrile
CID 82870674
4-(methylaminomethyl)-4-[(1-methylpyrazol-3-yl)methyl]cyclohexan-1-ol
CID 112745382
2-(aminomethyl)-2-[(1-methylpyrazol-3-yl)methyl]cyclohexan-1-ol
CID 82870793
3-[(3-ethylazetidin-3-yl)methyl]-1-methylpyrazole
CID 82882602
3-[[1-(bromomethyl)cyclopentyl]methyl]-1-methylpyrazole
CID 82872091
3-amino-1-[(1-methylpyrazol-3-yl)methyl]cyclobutan-1-ol
CID 82868484
[4-butyl-1-[(1-methylpyrazol-3-yl)methyl]cyclohexyl]methanol
CID 82870443
3-[[4-butyl-1-(chloromethyl)cyclohexyl]methyl]-1-methylpyrazole
CID 82870698

Frequently Asked Questions

What is the IUPAC name of [3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine?
The IUPAC name of [3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine (CID 82871482) is [3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine.
What is the SMILES notation for [3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine?
The canonical SMILES for [3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine is CC1CCC(CN)(Cc2ccn(C)n2)C1.
What is the InChIKey of [3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine?
The InChIKey is FVSCAMZZOGDJME-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-10-3-5-12(7-10,9-13)8-11-4-6-15(2)14-11/h4,6,10H,3,5,7-9,13H2,1-2H3.
What are the key properties of [3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine?
[3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine has a molecular weight of 207.32 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-1-[(1-methylpyrazol-3-yl)methyl]cyclopentyl]methanamine is sourced from PubChem (CID 82871482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).