2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine

C14H26N4 — CID 113261232

IUPAC2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine
SMILESCCn1cc(C(C)NCC(C)N(C)C2CC2)cn1
InChIInChI=1S/C14H26N4/c1-5-18-10-13(9-16-18)12(3)15-8-11(2)17(4)14-6-7-14/h9-12,14-15H,5-8H2,1-4H3
InChIKeyWPNCNHRCIJOPQM-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.04
Rot. Bonds7

About 2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine

2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine (PubChem CID 113261232) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine
PubChem CID113261232
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine
SMILESCCn1cc(C(C)NCC(C)N(C)C2CC2)cn1
InChIInChI=1S/C14H26N4/c1-5-18-10-13(9-16-18)12(3)15-8-11(2)17(4)14-6-7-14/h9-12,14-15H,5-8H2,1-4H3
InChIKeyWPNCNHRCIJOPQM-UHFFFAOYSA-N
XLogP2.04
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine?
The IUPAC name of 2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine (CID 113261232) is 2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine.
What is the SMILES notation for 2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine?
The canonical SMILES for 2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine is CCn1cc(C(C)NCC(C)N(C)C2CC2)cn1.
What is the InChIKey of 2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine?
The InChIKey is WPNCNHRCIJOPQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-5-18-10-13(9-16-18)12(3)15-8-11(2)17(4)14-6-7-14/h9-12,14-15H,5-8H2,1-4H3.
What are the key properties of 2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine?
2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine has a molecular weight of 250.39 g/mol, XLogP of 2.04, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-1-N-[1-(1-ethylpyrazol-4-yl)ethyl]-2-N-methylpropane-1,2-diamine is sourced from PubChem (CID 113261232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).