N-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine

C15H28N2 — CID 103070072

IUPACN-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine
SMILESC=C(CNC1CC1)CN(C)C1CCCCC1C
InChIInChI=1S/C15H28N2/c1-12(10-16-14-8-9-14)11-17(3)15-7-5-4-6-13(15)2/h13-16H,1,4-11H2,2-3H3
InChIKeyXAAWFDFMJRTZFW-UHFFFAOYSA-N
MW236.40 g/mol
LogP2.81
Rot. Bonds6

About N-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine

N-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine (PubChem CID 103070072) has the molecular formula C15H28N2 and a molecular weight of 236.40 g/mol. Its IUPAC name is N-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine
PubChem CID103070072
Molecular FormulaC15H28N2
Molecular Weight236.40 g/mol
Exact Mass236.23
IUPAC NameN-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine
SMILESC=C(CNC1CC1)CN(C)C1CCCCC1C
InChIInChI=1S/C15H28N2/c1-12(10-16-14-8-9-14)11-17(3)15-7-5-4-6-13(15)2/h13-16H,1,4-11H2,2-3H3
InChIKeyXAAWFDFMJRTZFW-UHFFFAOYSA-N
XLogP2.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 52.81
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'-(1,1-dioxothiolan-3-yl)-N'-methyl-2-methylidenepropane-1,3-diamine
CID 103069495
2-(cyclopentylamino)-N-methyl-N-(2-methylcyclohexyl)acetamide
CID 60939306
N-cyclopentyl-N'-cyclopropyl-N-ethyl-2-methylidenepropane-1,3-diamine
CID 103069362
N'-methyl-N'-(2-methylcyclohexyl)-N-(4-methylcyclohexyl)ethane-1,2-diamine
CID 63502047
N-cyclopropyl-2-methylidene-N',N'-dipropylpropane-1,3-diamine
CID 103068881
N'-hydroxy-2-[methyl-(2-methylcyclohexyl)amino]ethanimidamide
CID 76912047
N-(2-methylidenebutyl)cycloheptanamine
CID 66045688
N-cyclopropyl-N'-methyl-2-methylidene-N'-[(1-methylpyrrolidin-2-yl)methyl]propane-1,3-diamine
CID 103070924
N-butan-2-yl-N'-cyclopropyl-N-ethyl-2-methylidenepropane-1,3-diamine
CID 103069214
N-cyclopropyl-N'-methyl-2-methylidene-N'-(1-thiophen-2-ylethyl)propane-1,3-diamine
CID 103069890
ethyl 4-[methyl-(2-methylcyclohexyl)amino]-3-oxobutanoate
CID 63898118
3-methyl-4-[methyl-(2-methylcyclohexyl)amino]but-2-enoic acid
CID 77005838

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine?
The IUPAC name of N-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine (CID 103070072) is N-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine.
What is the SMILES notation for N-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine?
The canonical SMILES for N-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine is C=C(CNC1CC1)CN(C)C1CCCCC1C.
What is the InChIKey of N-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine?
The InChIKey is XAAWFDFMJRTZFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2/c1-12(10-16-14-8-9-14)11-17(3)15-7-5-4-6-13(15)2/h13-16H,1,4-11H2,2-3H3.
What are the key properties of N-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine?
N-cyclopropyl-N'-methyl-N'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine has a molecular weight of 236.40 g/mol, XLogP of 2.81, 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'-(2-methylcyclohexyl)-2-methylidenepropane-1,3-diamine is sourced from PubChem (CID 103070072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).