N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine

C10H22N2 — CID 91064038

IUPACN'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine
SMILESCNCCCNC(C)CC1CC1
InChIInChI=1S/C10H22N2/c1-9(8-10-4-5-10)12-7-3-6-11-2/h9-12H,3-8H2,1-2H3
InChIKeyFEIAUBPUDKWZLQ-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.37
Rot. Bonds7

About N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine

N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine (PubChem CID 91064038) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine
PubChem CID91064038
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine
SMILESCNCCCNC(C)CC1CC1
InChIInChI=1S/C10H22N2/c1-9(8-10-4-5-10)12-7-3-6-11-2/h9-12H,3-8H2,1-2H3
InChIKeyFEIAUBPUDKWZLQ-UHFFFAOYSA-N
XLogP1.37
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-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-(1-cyclopropylpropan-2-yl)-4-methylpentan-1-amine
CID 81300289
1-cyclopropyl-N-(3-cyclopropylpropyl)propan-2-amine
CID 115890825
N-(1-cyclopropylpropan-2-yl)pent-4-yn-1-amine
CID 115724863
1-cyclopropyl-N-(3-methylsulfinylpropyl)propan-2-amine
CID 115721005
N-(1-cyclopropylpropan-2-yl)-6-methylsulfanylhexan-1-amine
CID 104537240
1-cyclopropyl-N-(2-methylsulfanylethyl)propan-2-amine
CID 115706204
N-[3-(1-cyclobutylpropan-2-ylamino)propyl]methanesulfonamide
CID 115708208
N-(3-cyclohexyloxypropyl)-1-cyclopropylpropan-2-amine
CID 115707843
(E)-N-(1-cyclopropylpropan-2-yl)pent-3-en-1-amine
CID 115890255
N-(1-cyclobutylpropan-2-yl)-N',N'-dimethylpropane-1,3-diamine
CID 115705382
3-(1-cyclopropylpropan-2-ylamino)-N'-hydroxypropanimidamide
CID 77028692
N-(1-cyclohexylpropan-2-yl)-N',N'-dimethylpropane-1,3-diamine
CID 165494361

Frequently Asked Questions

What is the IUPAC name of N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine?
The IUPAC name of N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine (CID 91064038) is N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine.
What is the SMILES notation for N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine?
The canonical SMILES for N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine is CNCCCNC(C)CC1CC1.
What is the InChIKey of N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine?
The InChIKey is FEIAUBPUDKWZLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-9(8-10-4-5-10)12-7-3-6-11-2/h9-12H,3-8H2,1-2H3.
What are the key properties of N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine?
N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.37, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-cyclopropylpropan-2-yl)-N-methylpropane-1,3-diamine is sourced from PubChem (CID 91064038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).