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

C10H22N2 — CID 60852014

IUPACN'-cyclopropyl-N'-methyl-N-propan-2-ylpropane-1,3-diamine
SMILESCC(C)NCCCN(C)C1CC1
InChIInChI=1S/C10H22N2/c1-9(2)11-7-4-8-12(3)10-5-6-10/h9-11H,4-8H2,1-3H3
InChIKeyUBQQKRLHUBDFQZ-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.47
Rot. Bonds6

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

N'-cyclopropyl-N'-methyl-N-propan-2-ylpropane-1,3-diamine (PubChem CID 60852014) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N'-cyclopropyl-N'-methyl-N-propan-2-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-N'-methyl-N-propan-2-ylpropane-1,3-diamine
PubChem CID60852014
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN'-cyclopropyl-N'-methyl-N-propan-2-ylpropane-1,3-diamine
SMILESCC(C)NCCCN(C)C1CC1
InChIInChI=1S/C10H22N2/c1-9(2)11-7-4-8-12(3)10-5-6-10/h9-11H,4-8H2,1-3H3
InChIKeyUBQQKRLHUBDFQZ-UHFFFAOYSA-N
XLogP1.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N'-cyclopropyl-N'-methyl-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

Related Compounds

N'-(4-ethylcyclohexyl)-N'-methyl-N-propan-2-ylpentane-1,5-diamine
CID 62412330
N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]cyclopropanamine
CID 102740741
N-[2-[cyclopropyl(methyl)amino]ethyl]-3-(propan-2-ylamino)propane-1-sulfonamide
CID 55142009
N'-cyclopropyl-N'-ethyl-N-propan-2-ylpropane-1,3-diamine
CID 60852013
N'-cyclohexyl-N'-methyl-N-(3-methylpentan-2-yl)propane-1,3-diamine
CID 54880326
N'-methyl-N'-(oxolan-3-yl)-N-propan-2-ylpentane-1,5-diamine
CID 82754082
N'-cycloheptyl-N,N'-dimethylpropane-1,3-diamine
CID 61387268
N'-cyclohexyl-N'-methyl-N-(3-methylbutyl)propane-1,3-diamine
CID 60732733
N'-cyclohexyl-N-[1-(4-iodophenyl)ethyl]-N'-methylpropane-1,3-diamine
CID 63452116
N-methyl-N-[2-[1-[2-(propan-2-ylamino)ethyl]cyclobutyl]oxyethyl]cyclopropanamine
CID 102740876
N'-cyclohexyl-N'-methyl-N-(1-thiophen-2-ylethyl)propane-1,3-diamine
CID 54880288
N'-cyclohexyl-N'-methyl-N-(4-propan-2-ylcyclohexyl)propane-1,3-diamine
CID 63451987

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-N'-methyl-N-propan-2-ylpropane-1,3-diamine?
The IUPAC name of N'-cyclopropyl-N'-methyl-N-propan-2-ylpropane-1,3-diamine (CID 60852014) is N'-cyclopropyl-N'-methyl-N-propan-2-ylpropane-1,3-diamine.
What is the SMILES notation for N'-cyclopropyl-N'-methyl-N-propan-2-ylpropane-1,3-diamine?
The canonical SMILES for N'-cyclopropyl-N'-methyl-N-propan-2-ylpropane-1,3-diamine is CC(C)NCCCN(C)C1CC1.
What is the InChIKey of N'-cyclopropyl-N'-methyl-N-propan-2-ylpropane-1,3-diamine?
The InChIKey is UBQQKRLHUBDFQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-9(2)11-7-4-8-12(3)10-5-6-10/h9-11H,4-8H2,1-3H3.
What are the key properties of N'-cyclopropyl-N'-methyl-N-propan-2-ylpropane-1,3-diamine?
N'-cyclopropyl-N'-methyl-N-propan-2-ylpropane-1,3-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.47, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N'-methyl-N-propan-2-ylpropane-1,3-diamine is sourced from PubChem (CID 60852014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).