2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine

C13H23N3 — CID 114556145

IUPAC2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine
SMILESCCCn1nccc1CNCC(C)C1CC1
InChIInChI=1S/C13H23N3/c1-3-8-16-13(6-7-15-16)10-14-9-11(2)12-4-5-12/h6-7,11-12,14H,3-5,8-10H2,1-2H3
InChIKeyMQWGWEJLMXVAJM-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.43
Rot. Bonds7

About 2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine

2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine (PubChem CID 114556145) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine
PubChem CID114556145
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine
SMILESCCCn1nccc1CNCC(C)C1CC1
InChIInChI=1S/C13H23N3/c1-3-8-16-13(6-7-15-16)10-14-9-11(2)12-4-5-12/h6-7,11-12,14H,3-5,8-10H2,1-2H3
InChIKeyMQWGWEJLMXVAJM-UHFFFAOYSA-N
XLogP2.43
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-cyclopropyl-N-[(2-propylpyrazol-3-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-(2-ethylpyrazol-3-yl)-N-[(2-propylpyrazol-3-yl)methyl]methanamine
CID 19625523
N-[[2-(2-fluoroethyl)pyrazol-3-yl]methyl]-1-(2-propylpyrazol-3-yl)methanamine
CID 122166952
N-[(2-propylpyrazol-3-yl)methyl]hydroxylamine
CID 114556004
1-(1-ethylpyrrolidin-2-yl)-N-[(2-propylpyrazol-3-yl)methyl]methanamine
CID 114554795
2-methyl-N-[(2-propylpyrazol-3-yl)methyl]prop-2-en-1-amine
CID 114615846
3-[(2-propylpyrazol-3-yl)methylamino]propan-1-ol
CID 114554889
N-(2-methylpropoxy)-1-(2-propylpyrazol-3-yl)methanamine
CID 114556013
3-methyl-N-[(2-propylpyrazol-3-yl)methyl]pentan-2-amine
CID 114555629
4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 114555631
4-ethyl-1-[[(2-propylpyrazol-3-yl)methylamino]methyl]cyclohexan-1-ol
CID 114555851
2-[(2-propylpyrazol-3-yl)methylamino]-1-thiophen-3-ylethanol
CID 114188500
3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine
CID 114556221

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine?
The IUPAC name of 2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine (CID 114556145) is 2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine.
What is the SMILES notation for 2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine?
The canonical SMILES for 2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine is CCCn1nccc1CNCC(C)C1CC1.
What is the InChIKey of 2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine?
The InChIKey is MQWGWEJLMXVAJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-3-8-16-13(6-7-15-16)10-14-9-11(2)12-4-5-12/h6-7,11-12,14H,3-5,8-10H2,1-2H3.
What are the key properties of 2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine?
2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine has a molecular weight of 221.35 g/mol, XLogP of 2.43, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine is sourced from PubChem (CID 114556145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).