N-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine

C13H28N2 — CID 61378678

IUPACN-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine
SMILESCC(C)CN(CCNC1CC1)CC(C)C
InChIInChI=1S/C13H28N2/c1-11(2)9-15(10-12(3)4)8-7-14-13-5-6-13/h11-14H,5-10H2,1-4H3
InChIKeyBCZYZEPNHOQHOZ-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.35
Rot. Bonds8

About N-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine

N-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine (PubChem CID 61378678) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine
PubChem CID61378678
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine
SMILESCC(C)CN(CCNC1CC1)CC(C)C
InChIInChI=1S/C13H28N2/c1-11(2)9-15(10-12(3)4)8-7-14-13-5-6-13/h11-14H,5-10H2,1-4H3
InChIKeyBCZYZEPNHOQHOZ-UHFFFAOYSA-N
XLogP2.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-N'-methyl-N'-(2-methylpropyl)propane-1,3-diamine
CID 60868035
1-[3-(cyclopropylamino)propyl-(2-hydroxypropyl)amino]propan-2-ol
CID 149151323
N-(dicyclopropylmethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine
CID 55090020
N-(cyclopropylmethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine
CID 61378857
N-(4-methylcyclohexyl)-N'-(2-methylpropyl)-N'-pentan-3-ylethane-1,2-diamine
CID 79489086
N'-methyl-N'-(3-methylbutyl)-N-(4-methylcyclohexyl)ethane-1,2-diamine
CID 55089565
N-[[5-[[ethyl(2-methylpropyl)amino]methyl]oxolan-2-yl]methyl]cyclopropanamine
CID 55074640
N-cyclohexyl-N'-(2-methylpropyl)-N'-pentan-3-ylethane-1,2-diamine
CID 79490778
N',N'-diethyl-N-[1-(2-methylpropyl)piperidin-4-yl]ethane-1,2-diamine
CID 103775624
N-(4-chlorocyclohexyl)-N',N'-diethylethane-1,2-diamine
CID 107913675
N,N,N',N'-tetrakis(2-methylpropyl)ethane-1,2-diamine
CID 18709992
N'-cyclopropyl-2,2-diethyl-N,N-bis(2-methylpropyl)propane-1,3-diamine
CID 63495326

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine?
The IUPAC name of N-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine (CID 61378678) is N-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine.
What is the SMILES notation for N-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine?
The canonical SMILES for N-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine is CC(C)CN(CCNC1CC1)CC(C)C.
What is the InChIKey of N-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine?
The InChIKey is BCZYZEPNHOQHOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-11(2)9-15(10-12(3)4)8-7-14-13-5-6-13/h11-14H,5-10H2,1-4H3.
What are the key properties of N-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine?
N-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine has a molecular weight of 212.38 g/mol, XLogP of 2.35, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N',N'-bis(2-methylpropyl)ethane-1,2-diamine is sourced from PubChem (CID 61378678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).