N-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine

C10H22N2 — CID 114525134

IUPACN-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine
SMILESCN(C)CCCNC1CC1(C)C
InChIInChI=1S/C10H22N2/c1-10(2)8-9(10)11-6-5-7-12(3)4/h9,11H,5-8H2,1-4H3
InChIKeyVZKFHLDDMILAMP-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.33
Rot. Bonds5

About N-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine

N-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine (PubChem CID 114525134) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine.

Molecular Properties

Compound NameN-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine
PubChem CID114525134
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine
SMILESCN(C)CCCNC1CC1(C)C
InChIInChI=1S/C10H22N2/c1-10(2)8-9(10)11-6-5-7-12(3)4/h9,11H,5-8H2,1-4H3
InChIKeyVZKFHLDDMILAMP-UHFFFAOYSA-N
XLogP1.33
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 ≤ 51.33
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-dimethylcyclohexyl)-N',N'-dimethylpropane-1,3-diamine
CID 79828762
N-butyl-2,2-dimethylcyclopropan-1-amine
CID 61223200
N-(2,2-dimethyl-1,3-dioxan-5-yl)-N',N'-dimethylpropane-1,3-diamine
CID 106658058
N'-(2,2-dimethylcyclopropyl)-3,3-dimethylhexane-1,6-diamine
CID 65296505
N-[(2,2-dimethylcyclopropyl)methyl]-N',N'-dimethylethane-1,2-diamine
CID 107001471
N'-cyclohexyl-N-(2,2-dimethylcyclohexyl)-N'-methylpropane-1,3-diamine
CID 79834348
N',N'-dimethyl-N-[(1R,2S)-2-methylcyclopentyl]propane-1,3-diamine
CID 96923135
N-cyclopentyl-N'-[3-(dimethylamino)propyl]-N'-methylpropane-1,3-diamine
CID 63726529
2,2-dimethyl-N-pent-3-ynylcyclopropan-1-amine
CID 104806676
N-(1,1-dioxothian-4-yl)-N',N'-dimethylpropane-1,3-diamine
CID 43511552
N-(2,2-dimethylcyclohexyl)-N',N'-diethylpropane-1,3-diamine
CID 79828517
N-(2-ethyl-2-methyl-3,4-dihydrochromen-4-yl)-N',N'-dimethylpropane-1,3-diamine
CID 82462120

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine?
The IUPAC name of N-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine (CID 114525134) is N-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine.
What is the SMILES notation for N-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine?
The canonical SMILES for N-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine is CN(C)CCCNC1CC1(C)C.
What is the InChIKey of N-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine?
The InChIKey is VZKFHLDDMILAMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-10(2)8-9(10)11-6-5-7-12(3)4/h9,11H,5-8H2,1-4H3.
What are the key properties of N-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine?
N-(2,2-dimethylcyclopropyl)-N',N'-dimethylpropane-1,3-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.33, 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)-N',N'-dimethylpropane-1,3-diamine is sourced from PubChem (CID 114525134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).