1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine

C15H27N3O — CID 116719628

IUPAC1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine
SMILESCOC(C(C)C)C(N)Cc1ccn(C2CCCC2)n1
InChIInChI=1S/C15H27N3O/c1-11(2)15(19-3)14(16)10-12-8-9-18(17-12)13-6-4-5-7-13/h8-9,11,13-15H,4-7,10,16H2,1-3H3
InChIKeyUUTHIAPXFSGGME-UHFFFAOYSA-N
MW265.40 g/mol
LogP2.54
Rot. Bonds6

About 1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine

1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine (PubChem CID 116719628) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine.

Molecular Properties

Compound Name1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine
PubChem CID116719628
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine
SMILESCOC(C(C)C)C(N)Cc1ccn(C2CCCC2)n1
InChIInChI=1S/C15H27N3O/c1-11(2)15(19-3)14(16)10-12-8-9-18(17-12)13-6-4-5-7-13/h8-9,11,13-15H,4-7,10,16H2,1-3H3
InChIKeyUUTHIAPXFSGGME-UHFFFAOYSA-N
XLogP2.54
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-cyclohexylpyrazol-3-yl)-3-methoxy-N,4-dimethylpentan-2-amine
CID 116720039
dimethyl 2-[(1-cyclopentylpyrazol-3-yl)methyl]propanedioate
CID 103972375
1-(1-cyclohexylpyrazol-3-yl)-3-methoxypropan-2-amine
CID 64779791
1-(1-cyclohexylpyrazol-3-yl)-3-methoxybutan-2-ol
CID 79616778
1-(1-cyclopentylpyrazol-3-yl)butan-2-amine
CID 64785877
3-(2-chloropropyl)-1-cyclopentylpyrazole
CID 130480485
2-[(1-cyclohexylpyrazol-3-yl)methyl]-3-methylbutan-1-amine
CID 64778280
4-(1-cyclopentylpyrazol-3-yl)-3-methylbutan-1-amine
CID 81013541
1-(1-cyclopentylpyrazol-3-yl)-4-methylpentane-2,3-diol
CID 103456685
1-cycloheptyl-2-(1-cyclohexylpyrazol-3-yl)ethanamine
CID 65399634
1-(1-cyclopentylpyrazol-3-yl)-3-ethylheptan-2-amine
CID 104993863
[1-(1-cyclohexylpyrazol-3-yl)-5-methoxyhexan-2-yl]hydrazine
CID 105311723

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine?
The IUPAC name of 1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine (CID 116719628) is 1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine.
What is the SMILES notation for 1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine?
The canonical SMILES for 1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine is COC(C(C)C)C(N)Cc1ccn(C2CCCC2)n1.
What is the InChIKey of 1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine?
The InChIKey is UUTHIAPXFSGGME-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-11(2)15(19-3)14(16)10-12-8-9-18(17-12)13-6-4-5-7-13/h8-9,11,13-15H,4-7,10,16H2,1-3H3.
What are the key properties of 1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine?
1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine has a molecular weight of 265.40 g/mol, XLogP of 2.54, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopentylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-amine is sourced from PubChem (CID 116719628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).