N-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine

C12H24N2 — CID 103070023

IUPACN-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine
SMILESC=C(CNC)CN(CC(C)C)C1CC1
InChIInChI=1S/C12H24N2/c1-10(2)8-14(12-5-6-12)9-11(3)7-13-4/h10,12-13H,3,5-9H2,1-2,4H3
InChIKeyRLIGVAPOVIKIBJ-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.88
Rot. Bonds7

About N-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine

N-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine (PubChem CID 103070023) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine
PubChem CID103070023
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine
SMILESC=C(CNC)CN(CC(C)C)C1CC1
InChIInChI=1S/C12H24N2/c1-10(2)8-14(12-5-6-12)9-11(3)7-13-4/h10,12-13H,3,5-9H2,1-2,4H3
InChIKeyRLIGVAPOVIKIBJ-UHFFFAOYSA-N
XLogP1.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopropyl-N'-ethyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine
CID 103070025
2-[[cyclopentyl(2-methylpropyl)amino]methyl]prop-2-ene-1-thiol
CID 103073510
N-cyclopropyl-N'-ethyl-N-(3-methylbutyl)-2-methylidenepropane-1,3-diamine
CID 103070074
3-[cyclobutyl-[2-(methylaminomethyl)prop-2-enyl]amino]propan-1-ol
CID 103071457
N-methyl-2-methylidene-N'-(2-methylpropyl)-N'-pentan-3-ylpropane-1,3-diamine
CID 103070963
N-cyclopropyl-N,N'-diethyl-2-methylidenepropane-1,3-diamine
CID 103069258
N'-cyclopropyl-N'-(3-methylbutyl)-2-methylidenepropane-1,3-diamine
CID 103070075
N-butyl-N-cyclopropyl-2-methylidene-N'-propan-2-ylpropane-1,3-diamine
CID 103069805
N-(4,4-dimethylcyclohexyl)-N,N'-dimethyl-2-methylidenepropane-1,3-diamine
CID 103071030
2-[cyclopentyl(2-methylpropyl)amino]acetic acid
CID 60835237
N-[[5-(methylaminomethyl)furan-2-yl]methyl]-N-(2-methylpropyl)cyclopropanamine
CID 62429023
2-[(4-tert-butylcycloheptyl)-(2-methylpropyl)amino]acetic acid
CID 65094431

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine?
The IUPAC name of N-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine (CID 103070023) is N-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine.
What is the SMILES notation for N-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine?
The canonical SMILES for N-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine is C=C(CNC)CN(CC(C)C)C1CC1.
What is the InChIKey of N-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine?
The InChIKey is RLIGVAPOVIKIBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-10(2)8-14(12-5-6-12)9-11(3)7-13-4/h10,12-13H,3,5-9H2,1-2,4H3.
What are the key properties of N-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine?
N-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine has a molecular weight of 196.34 g/mol, XLogP of 1.88, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N'-methyl-2-methylidene-N-(2-methylpropyl)propane-1,3-diamine is sourced from PubChem (CID 103070023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).