N'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine

C9H20N2 — CID 43137500

IUPACN'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine
SMILESCC(C)N(CCCN)C1CC1
InChIInChI=1S/C9H20N2/c1-8(2)11(7-3-6-10)9-4-5-9/h8-9H,3-7,10H2,1-2H3
InChIKeyGUDSKGNJENPVCC-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.21
Rot. Bonds5

About N'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine

N'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine (PubChem CID 43137500) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is N'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine
PubChem CID43137500
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC NameN'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine
SMILESCC(C)N(CCCN)C1CC1
InChIInChI=1S/C9H20N2/c1-8(2)11(7-3-6-10)9-4-5-9/h8-9H,3-7,10H2,1-2H3
InChIKeyGUDSKGNJENPVCC-UHFFFAOYSA-N
XLogP1.21
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N'-cyclopropyl-N'-propan-2-ylpropane-1,3-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 N'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine?
The IUPAC name of N'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine (CID 43137500) is N'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine.
What is the SMILES notation for N'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine?
The canonical SMILES for N'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine is CC(C)N(CCCN)C1CC1.
What is the InChIKey of N'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine?
The InChIKey is GUDSKGNJENPVCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-8(2)11(7-3-6-10)9-4-5-9/h8-9H,3-7,10H2,1-2H3.
What are the key properties of N'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine?
N'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine has a molecular weight of 156.27 g/mol, XLogP of 1.21, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N'-propan-2-ylpropane-1,3-diamine is sourced from PubChem (CID 43137500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).