1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine

C13H23N3 — CID 79225182

IUPAC1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine
SMILESCCC(NCc1c(C)nn(C)c1C)C1CC1
InChIInChI=1S/C13H23N3/c1-5-13(11-6-7-11)14-8-12-9(2)15-16(4)10(12)3/h11,13-14H,5-8H2,1-4H3
InChIKeyXUNBUXBIKYEFDJ-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.32
Rot. Bonds5

About 1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine

1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine (PubChem CID 79225182) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine
PubChem CID79225182
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine
SMILESCCC(NCc1c(C)nn(C)c1C)C1CC1
InChIInChI=1S/C13H23N3/c1-5-13(11-6-7-11)14-8-12-9(2)15-16(4)10(12)3/h11,13-14H,5-8H2,1-4H3
InChIKeyXUNBUXBIKYEFDJ-UHFFFAOYSA-N
XLogP2.32
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-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

1-cyclopropyl-N-[(1,5-dimethylpyrazol-4-yl)methyl]propan-1-amine
CID 115896751
N-methyl-1-(4-methylcyclohexyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethanamine
CID 105153695
1-cyclobutyl-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
CID 105187556
[1-cyclobutyl-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine
CID 105340222
N-(1-cyclopropylbutyl)-1,3,5-trimethylpyrazol-4-amine
CID 115927532
1-(oxan-4-yl)-N-propyl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
CID 105147287
3-methyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]butan-1-ol
CID 79254884
N-tert-butyl-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]propanamide
CID 78990459
N'-hydroxy-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]butanimidamide
CID 79241428
1-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]propan-1-amine
CID 64918015
[1-cyclohexyl-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105282113
1-methoxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine
CID 43180580

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine?
The IUPAC name of 1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine (CID 79225182) is 1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine.
What is the SMILES notation for 1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine?
The canonical SMILES for 1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine is CCC(NCc1c(C)nn(C)c1C)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine?
The InChIKey is XUNBUXBIKYEFDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-5-13(11-6-7-11)14-8-12-9(2)15-16(4)10(12)3/h11,13-14H,5-8H2,1-4H3.
What are the key properties of 1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine?
1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine has a molecular weight of 221.35 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine is sourced from PubChem (CID 79225182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).