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

C10H22N2 — CID 79202690

IUPACN-(2,2-dimethylcyclopropyl)-N',2-dimethylpropane-1,3-diamine
SMILESCNCC(C)CNC1CC1(C)C
InChIInChI=1S/C10H22N2/c1-8(6-11-4)7-12-9-5-10(9,2)3/h8-9,11-12H,5-7H2,1-4H3
InChIKeyDLVLQISFFLQHRS-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.23
Rot. Bonds5

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

N-(2,2-dimethylcyclopropyl)-N',2-dimethylpropane-1,3-diamine (PubChem CID 79202690) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N-(2,2-dimethylcyclopropyl)-N',2-dimethylpropane-1,3-diamine.

Molecular Properties

Compound NameN-(2,2-dimethylcyclopropyl)-N',2-dimethylpropane-1,3-diamine
PubChem CID79202690
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN-(2,2-dimethylcyclopropyl)-N',2-dimethylpropane-1,3-diamine
SMILESCNCC(C)CNC1CC1(C)C
InChIInChI=1S/C10H22N2/c1-8(6-11-4)7-12-9-5-10(9,2)3/h8-9,11-12H,5-7H2,1-4H3
InChIKeyDLVLQISFFLQHRS-UHFFFAOYSA-N
XLogP1.23
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N'-[[(1S,2R)-2-[4-(ethylamino)butylamino]cyclopropyl]methyl]butane-1,4-diamine
CID 45266925
N-(3-methylbutyl)cyclopropanamine hydrochloride
CID 24686262
n1,n3-Diisopropyl-2,2-dimethylpropane-1,3-diamine
CID 12707287
N-(Pyrrolidin-3-ylmethyl)cyclopropanamine
CID 13491801
N-(1-cyclopropylethyl)propan-1-amine
CID 24701914
N-Isopentylcyclopropanamine
CID 16771607
(2R,3S)-N-cyclopropyl-3-fluoro-N',2-dimethylbutane-1,4-diamine
CID 89228286
(2R)-N-[(2,2-difluoro-1-methylcyclopropyl)methyl]-3-methylbutan-2-amine
CID 178661085
1-Butanamine, 3-methyl, N-(1-methylethyl)
CID 527114
N-butan-2-yl-3-methylbutan-1-amine
CID 43177317
N-cyclopropyl-2-ethyl-2-methyl-N'-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propane-1,3-diamine
CID 62256739
1-N-cyclopropyl-2-methyl-3-N-propan-2-yl-3-N-(2,2,2-trifluoroethyl)butane-1,3-diamine
CID 79408611

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylcyclopropyl)-N',2-dimethylpropane-1,3-diamine?
The IUPAC name of N-(2,2-dimethylcyclopropyl)-N',2-dimethylpropane-1,3-diamine (CID 79202690) is N-(2,2-dimethylcyclopropyl)-N',2-dimethylpropane-1,3-diamine.
What is the SMILES notation for N-(2,2-dimethylcyclopropyl)-N',2-dimethylpropane-1,3-diamine?
The canonical SMILES for N-(2,2-dimethylcyclopropyl)-N',2-dimethylpropane-1,3-diamine is CNCC(C)CNC1CC1(C)C.
What is the InChIKey of N-(2,2-dimethylcyclopropyl)-N',2-dimethylpropane-1,3-diamine?
The InChIKey is DLVLQISFFLQHRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-8(6-11-4)7-12-9-5-10(9,2)3/h8-9,11-12H,5-7H2,1-4H3.
What are the key properties of N-(2,2-dimethylcyclopropyl)-N',2-dimethylpropane-1,3-diamine?
N-(2,2-dimethylcyclopropyl)-N',2-dimethylpropane-1,3-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.23, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylcyclopropyl)-N',2-dimethylpropane-1,3-diamine is sourced from PubChem (CID 79202690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).