N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine

C14H25N3 — CID 64801383

IUPACN-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine
SMILESCCC(C)(C)NCc1ccn(C2CCCC2)n1
InChIInChI=1S/C14H25N3/c1-4-14(2,3)15-11-12-9-10-17(16-12)13-7-5-6-8-13/h9-10,13,15H,4-8,11H2,1-3H3
InChIKeyWLARKYPHUARNPP-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.28
Rot. Bonds5

About N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine

N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine (PubChem CID 64801383) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine.

Molecular Properties

Compound NameN-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine
PubChem CID64801383
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine
SMILESCCC(C)(C)NCc1ccn(C2CCCC2)n1
InChIInChI=1S/C14H25N3/c1-4-14(2,3)15-11-12-9-10-17(16-12)13-7-5-6-8-13/h9-10,13,15H,4-8,11H2,1-3H3
InChIKeyWLARKYPHUARNPP-UHFFFAOYSA-N
XLogP3.28
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1-cyclohexylpyrazol-3-yl)methylamino]-2-methylbutan-1-ol
CID 64800330
N-[(1-cyclohexylpyrazol-3-yl)methyl]-2,2-dimethylbutan-1-amine
CID 103461395
2-[(1-cyclopentylpyrazol-3-yl)methylamino]-2-methylpropanamide
CID 64800668
2-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-1-amine
CID 64779672
1-cyclohexyl-3-ethylpyrazole
CID 66014335
1-(1-cyclohexylpyrazol-3-yl)-N-ethoxymethanamine
CID 64975019
N-[(1-cyclopentylpyrazol-3-yl)methyl]butan-2-amine
CID 64801770
N-[(1-cyclopentylpyrazol-3-yl)methyl]-4-methylaniline
CID 19626027
N-[(1-cyclohexylpyrazol-3-yl)methyl]pentan-3-amine
CID 64799267
3-chloro-N-[(1-cyclopentylpyrazol-3-yl)methyl]-2,2-dimethylpropan-1-amine
CID 113294661
2-[[(1-cyclohexylpyrazol-3-yl)methylamino]methyl]-2-ethylbutan-1-ol
CID 106256545
N-[(1-cyclopentylpyrazol-3-yl)methyl]-1-(4-ethylphenyl)methanamine
CID 103816376

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine?
The IUPAC name of N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine (CID 64801383) is N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine.
What is the SMILES notation for N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine?
The canonical SMILES for N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine is CCC(C)(C)NCc1ccn(C2CCCC2)n1.
What is the InChIKey of N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine?
The InChIKey is WLARKYPHUARNPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-4-14(2,3)15-11-12-9-10-17(16-12)13-7-5-6-8-13/h9-10,13,15H,4-8,11H2,1-3H3.
What are the key properties of N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine?
N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine has a molecular weight of 235.37 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-2-amine is sourced from PubChem (CID 64801383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).