2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine

C18H25N3 — CID 81473453

IUPAC2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine
SMILESCC(NC1CCC(C)C1C)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C18H25N3/c1-13-9-10-18(14(13)2)20-15(3)16-11-19-21(12-16)17-7-5-4-6-8-17/h4-8,11-15,18,20H,9-10H2,1-3H3
InChIKeyHRFFWLPPCAJTLN-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.96
Rot. Bonds4

About 2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine

2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine (PubChem CID 81473453) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine
PubChem CID81473453
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine
SMILESCC(NC1CCC(C)C1C)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C18H25N3/c1-13-9-10-18(14(13)2)20-15(3)16-11-19-21(12-16)17-7-5-4-6-8-17/h4-8,11-15,18,20H,9-10H2,1-3H3
InChIKeyHRFFWLPPCAJTLN-UHFFFAOYSA-N
XLogP3.96
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(1-phenylpyrazol-4-yl)ethyl]thiolan-3-amine
CID 103902666
1-(1-phenylpyrazol-4-yl)ethylhydrazine
CID 81470645
(1S)-1-cyclopentyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]ethanamine
CID 81473468
3-methyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]butan-2-amine
CID 81300600
N-methoxy-1-(1-phenylpyrazol-4-yl)ethanamine
CID 82706482
N-(oxolan-3-ylmethyl)-1-(1-phenylpyrazol-4-yl)ethanamine
CID 81328589
N-methyl-1-(2-methylcyclopropyl)-1-(1-phenylpyrazol-4-yl)methanamine
CID 43486036
N-methyl-1-(2-methylcyclopentyl)-1-(1-phenylpyrazol-4-yl)methanamine
CID 107177279
2-[1-(1-phenylpyrazol-4-yl)ethylamino]ethanol
CID 81302041
2-[1-(1-phenylpyrazol-4-yl)ethylamino]propan-1-ol
CID 81343823
2-[1-[(2,3-dimethylcyclopentyl)amino]ethyl]phenol
CID 64908843
2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine
CID 64908416

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine?
The IUPAC name of 2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine (CID 81473453) is 2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine.
What is the SMILES notation for 2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine?
The canonical SMILES for 2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine is CC(NC1CCC(C)C1C)c1cnn(-c2ccccc2)c1.
What is the InChIKey of 2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine?
The InChIKey is HRFFWLPPCAJTLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-13-9-10-18(14(13)2)20-15(3)16-11-19-21(12-16)17-7-5-4-6-8-17/h4-8,11-15,18,20H,9-10H2,1-3H3.
What are the key properties of 2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine?
2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 3.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 81473453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).