N-propan-2-ylpiperazin-2-amine

C7H17N3 — CID 90744079

IUPACN-propan-2-ylpiperazin-2-amine
SMILESCC(C)NC1CNCCN1
InChIInChI=1S/C7H17N3/c1-6(2)10-7-5-8-3-4-9-7/h6-10H,3-5H2,1-2H3
InChIKeyLPGDBIBPVRBOGJ-UHFFFAOYSA-N
MW143.23 g/mol
LogP-0.50
Rot. Bonds2

About N-propan-2-ylpiperazin-2-amine

N-propan-2-ylpiperazin-2-amine (PubChem CID 90744079) has the molecular formula C7H17N3 and a molecular weight of 143.23 g/mol. Its IUPAC name is N-propan-2-ylpiperazin-2-amine.

Molecular Properties

Compound NameN-propan-2-ylpiperazin-2-amine
PubChem CID90744079
Molecular FormulaC7H17N3
Molecular Weight143.23 g/mol
Exact Mass143.14
IUPAC NameN-propan-2-ylpiperazin-2-amine
SMILESCC(C)NC1CNCCN1
InChIInChI=1S/C7H17N3/c1-6(2)10-7-5-8-3-4-9-7/h6-10H,3-5H2,1-2H3
InChIKeyLPGDBIBPVRBOGJ-UHFFFAOYSA-N
XLogP-0.50
TPSA36.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 5-0.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-propan-2-ylpiperazin-2-amine 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 N-propan-2-ylpiperazin-2-amine?
The IUPAC name of N-propan-2-ylpiperazin-2-amine (CID 90744079) is N-propan-2-ylpiperazin-2-amine.
What is the SMILES notation for N-propan-2-ylpiperazin-2-amine?
The canonical SMILES for N-propan-2-ylpiperazin-2-amine is CC(C)NC1CNCCN1.
What is the InChIKey of N-propan-2-ylpiperazin-2-amine?
The InChIKey is LPGDBIBPVRBOGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3/c1-6(2)10-7-5-8-3-4-9-7/h6-10H,3-5H2,1-2H3.
What are the key properties of N-propan-2-ylpiperazin-2-amine?
N-propan-2-ylpiperazin-2-amine has a molecular weight of 143.23 g/mol, XLogP of -0.50, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-ylpiperazin-2-amine is sourced from PubChem (CID 90744079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).