1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine

C15H27N3 — CID 64784145

IUPAC1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine
SMILESCNC(Cc1ccn(C2CCCC2)n1)CC(C)C
InChIInChI=1S/C15H27N3/c1-12(2)10-14(16-3)11-13-8-9-18(17-13)15-6-4-5-7-15/h8-9,12,14-16H,4-7,10-11H2,1-3H3
InChIKeyFBKHVQSVYKTJNI-UHFFFAOYSA-N
MW249.40 g/mol
LogP3.17
Rot. Bonds6

About 1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine

1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine (PubChem CID 64784145) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine.

Molecular Properties

Compound Name1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine
PubChem CID64784145
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine
SMILESCNC(Cc1ccn(C2CCCC2)n1)CC(C)C
InChIInChI=1S/C15H27N3/c1-12(2)10-14(16-3)11-13-8-9-18(17-13)15-6-4-5-7-15/h8-9,12,14-16H,4-7,10-11H2,1-3H3
InChIKeyFBKHVQSVYKTJNI-UHFFFAOYSA-N
XLogP3.17
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-cyclohexylpyrazol-3-yl)-4-methyl-N-propylpentan-2-amine
CID 64777028
[1-(1-cyclohexylpyrazol-3-yl)-4-methylpentan-2-yl]hydrazine
CID 105199131
1-(1-cyclopentylpyrazol-3-yl)-N-methyl-3-propylsulfanylpropan-2-amine
CID 65129377
1-butan-2-ylsulfanyl-3-(1-cyclopentylpyrazol-3-yl)-N-methylpropan-2-amine
CID 65136017
1-(1-cyclohexylpyrazol-3-yl)-5,5,5-trifluoro-N-methylpentan-2-amine
CID 79954390
4-(1-cyclohexylpyrazol-3-yl)-1-N,1-N,3-N-trimethylbutane-1,3-diamine
CID 115346312
1-(1-cyclopentylpyrazol-3-yl)-N-methyl-3-(thian-4-yl)propan-2-amine
CID 105157056
1-(1-cyclopentylpyrazol-3-yl)-4-ethoxy-N-methylbutan-2-amine
CID 105157055
1-(1-cyclohexylpyrazol-3-yl)-N-propylbutan-2-amine
CID 64779979
4-(1-cyclohexylpyrazol-3-yl)-3-methyl-N-(2-methylpropyl)butan-1-amine
CID 81012869
1-(1-cyclopentylpyrazol-3-yl)-N,3-dimethylhexan-2-amine
CID 104993857
1-(1-cyclohexylpyrazol-3-yl)-N-propylpentan-2-amine
CID 64778794

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine?
The IUPAC name of 1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine (CID 64784145) is 1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine.
What is the SMILES notation for 1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine?
The canonical SMILES for 1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine is CNC(Cc1ccn(C2CCCC2)n1)CC(C)C.
What is the InChIKey of 1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine?
The InChIKey is FBKHVQSVYKTJNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-12(2)10-14(16-3)11-13-8-9-18(17-13)15-6-4-5-7-15/h8-9,12,14-16H,4-7,10-11H2,1-3H3.
What are the key properties of 1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine?
1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine has a molecular weight of 249.40 g/mol, XLogP of 3.17, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine is sourced from PubChem (CID 64784145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).