N-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine

C12H24N2 — CID 107001497

IUPACN-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine
SMILESCN(CCNC1CC1)CC1CC1(C)C
InChIInChI=1S/C12H24N2/c1-12(2)8-10(12)9-14(3)7-6-13-11-4-5-11/h10-11,13H,4-9H2,1-3H3
InChIKeyLEOFTVJMBFRRIC-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.72
Rot. Bonds6

About N-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine

N-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine (PubChem CID 107001497) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine
PubChem CID107001497
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine
SMILESCN(CCNC1CC1)CC1CC1(C)C
InChIInChI=1S/C12H24N2/c1-12(2)8-10(12)9-14(3)7-6-13-11-4-5-11/h10-11,13H,4-9H2,1-3H3
InChIKeyLEOFTVJMBFRRIC-UHFFFAOYSA-N
XLogP1.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-N'-[(5,5-dimethyloxolan-2-yl)methyl]-N'-methylethane-1,2-diamine
CID 116522137
N'-(cyclohexylmethyl)-N'-methyl-N-(4-methylcyclohexyl)ethane-1,2-diamine
CID 63501893
N-cyclopropyl-N'-methyl-N'-[(1-methylpiperidin-3-yl)methyl]ethane-1,2-diamine
CID 115207045
N'-methyl-N-(oxan-4-yl)-N'-(oxan-4-ylmethyl)ethane-1,2-diamine
CID 55227027
N'-ethyl-N'-methyl-N-(4-propan-2-ylcyclohexyl)ethane-1,2-diamine
CID 62704092
N-cyclohexyl-N'-methyl-N'-(oxan-4-ylmethyl)ethane-1,2-diamine
CID 63707526
N-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine
CID 65175083
N-cyclopropyl-N'-methyl-N'-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)ethane-1,2-diamine
CID 107126634
N'-(cyclohexylmethyl)-N-cyclopropyl-N'-methylbutane-1,4-diamine
CID 62412368
N'-methyl-N'-(3-methylbutyl)-N-(4-methylcyclohexyl)ethane-1,2-diamine
CID 55089565
N'-[(2,2-dimethylcyclopentyl)methyl]-N-ethyl-N'-methylethane-1,2-diamine
CID 107178444
N'-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-N-cyclopropyl-N'-methylethane-1,2-diamine
CID 104563816

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine?
The IUPAC name of N-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine (CID 107001497) is N-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine.
What is the SMILES notation for N-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine?
The canonical SMILES for N-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine is CN(CCNC1CC1)CC1CC1(C)C.
What is the InChIKey of N-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine?
The InChIKey is LEOFTVJMBFRRIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-12(2)8-10(12)9-14(3)7-6-13-11-4-5-11/h10-11,13H,4-9H2,1-3H3.
What are the key properties of N-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine?
N-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine has a molecular weight of 196.34 g/mol, XLogP of 1.72, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N'-[(2,2-dimethylcyclopropyl)methyl]-N'-methylethane-1,2-diamine is sourced from PubChem (CID 107001497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).