[3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine

C15H25N3O — CID 114533961

IUPAC[3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine
SMILESCC1OCCC1(CN)Cc1ccn(C2CCCC2)n1
InChIInChI=1S/C15H25N3O/c1-12-15(11-16,7-9-19-12)10-13-6-8-18(17-13)14-4-2-3-5-14/h6,8,12,14H,2-5,7,9-11,16H2,1H3
InChIKeyCSCJPMMPJCONAY-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.29
Rot. Bonds4

About [3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine

[3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine (PubChem CID 114533961) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is [3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine.

Molecular Properties

Compound Name[3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine
PubChem CID114533961
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name[3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine
SMILESCC1OCCC1(CN)Cc1ccn(C2CCCC2)n1
InChIInChI=1S/C15H25N3O/c1-12-15(11-16,7-9-19-12)10-13-6-8-18(17-13)14-4-2-3-5-14/h6,8,12,14H,2-5,7,9-11,16H2,1H3
InChIKeyCSCJPMMPJCONAY-UHFFFAOYSA-N
XLogP2.29
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(1-cyclohexylpyrazol-3-yl)methyl]-3-methylcyclopentan-1-amine
CID 64785070
1-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylcyclohexan-1-amine
CID 64783322
[1-[(1-cyclopentylpyrazol-3-yl)methyl]-4-ethylcyclohexyl]methanamine
CID 65394733
1-[(1-cyclohexylpyrazol-3-yl)methyl]-3-ethylcyclohexan-1-amine
CID 64783907
1-[(1-cyclopentylpyrazol-3-yl)methyl]-3-methylcyclohexane-1-carbonitrile
CID 65378092
3-[[1-(bromomethyl)cyclopropyl]methyl]-1-cyclopentylpyrazole
CID 66049323
1-[(1-cyclopentylpyrazol-3-yl)methyl]-4-propylcyclohexan-1-amine
CID 64784480
[1-[(1-cyclohexylpyrazol-3-yl)methyl]cyclopropyl]methanol
CID 66024341
1-[1-[(1-cyclohexylpyrazol-3-yl)methyl]cyclopropyl]ethanone
CID 106797108
1-[(1-cyclopentylpyrazol-3-yl)methyl]-2,2-dimethylcyclopentan-1-ol
CID 79863268
1-[(1-cyclopentylpyrazol-3-yl)methyl]-2,2-dimethylcyclohexan-1-ol
CID 79852504
N-[[1-[(1-cyclopentylpyrazol-3-yl)methyl]cyclopropyl]methyl]ethanamine
CID 66026217

Frequently Asked Questions

What is the IUPAC name of [3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine?
The IUPAC name of [3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine (CID 114533961) is [3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine.
What is the SMILES notation for [3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine?
The canonical SMILES for [3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine is CC1OCCC1(CN)Cc1ccn(C2CCCC2)n1.
What is the InChIKey of [3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine?
The InChIKey is CSCJPMMPJCONAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-12-15(11-16,7-9-19-12)10-13-6-8-18(17-13)14-4-2-3-5-14/h6,8,12,14H,2-5,7,9-11,16H2,1H3.
What are the key properties of [3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine?
[3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine has a molecular weight of 263.38 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine is sourced from PubChem (CID 114533961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).