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

C10H22N2 — CID 107001471

IUPACN-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine
SMILESCN(C)CCNCC1CC1(C)C
InChIInChI=1S/C10H22N2/c1-10(2)7-9(10)8-11-5-6-12(3)4/h9,11H,5-8H2,1-4H3
InChIKeyZDUUTNFFUXVVMG-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.18
Rot. Bonds5

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

N-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine (PubChem CID 107001471) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine
PubChem CID107001471
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine
SMILESCN(C)CCNCC1CC1(C)C
InChIInChI=1S/C10H22N2/c1-10(2)7-9(10)8-11-5-6-12(3)4/h9,11H,5-8H2,1-4H3
InChIKeyZDUUTNFFUXVVMG-UHFFFAOYSA-N
XLogP1.18
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(2,2-dimethylcyclopropyl)methyl]-N',N'-diethylpropane-1,3-diamine
CID 107001512
N'-[(2,2-dimethylcyclopropyl)methyl]-N-propylpropane-1,3-diamine
CID 107001505
4-[[2-(dimethylamino)ethylamino]methyl]cyclohexan-1-ol
CID 106133697
N-[(3-chlorocyclobutyl)methyl]-N',N'-dimethylethane-1,2-diamine
CID 66005005
N-[(2,2-dimethylcyclopropyl)methyl]-3-pyrrolidin-1-ylpropan-1-amine
CID 107001513
N-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine
CID 114525134
N',N'-dimethyl-N-[(5-methyloxolan-2-yl)methyl]ethane-1,2-diamine
CID 82834863
5-[[2-(dimethylamino)ethylamino]methyl]pyrrolidin-2-one
CID 60726501
N',N'-dimethyl-N-[2-(3,3,5-trimethylcyclohexyl)oxyethyl]ethane-1,2-diamine
CID 62598860
N-but-2-ynyl-N',N'-dimethylethane-1,2-diamine
CID 62311533
3-chloro-N-[(2,2-dimethylcyclopropyl)methyl]-2-methylprop-2-en-1-amine
CID 106438250
N',N'-dimethyl-N-[[2-(trifluoromethyl)cyclohexyl]methyl]ethane-1,2-diamine
CID 113433967

Frequently Asked Questions

What is the IUPAC name of N-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine?
The IUPAC name of N-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine (CID 107001471) is N-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine?
The canonical SMILES for N-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine is CN(C)CCNCC1CC1(C)C.
What is the InChIKey of N-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine?
The InChIKey is ZDUUTNFFUXVVMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-10(2)7-9(10)8-11-5-6-12(3)4/h9,11H,5-8H2,1-4H3.
What are the key properties of N-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine?
N-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 107001471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).