3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine

C14H28N2 — CID 79350836

IUPAC3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine
SMILESCC1(C)C(NCC2CCCC(N)C2)C1(C)C
InChIInChI=1S/C14H28N2/c1-13(2)12(14(13,3)4)16-9-10-6-5-7-11(15)8-10/h10-12,16H,5-9,15H2,1-4H3
InChIKeyKRZXWEABZNAXLB-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.53
Rot. Bonds3

About 3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine

3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine (PubChem CID 79350836) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine
PubChem CID79350836
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine
SMILESCC1(C)C(NCC2CCCC(N)C2)C1(C)C
InChIInChI=1S/C14H28N2/c1-13(2)12(14(13,3)4)16-9-10-6-5-7-11(15)8-10/h10-12,16H,5-9,15H2,1-4H3
InChIKeyKRZXWEABZNAXLB-UHFFFAOYSA-N
XLogP2.53
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclohexanemethylamine, N-cyclopropyl-
CID 202172
4-tert-butyl-N-propan-2-ylcyclohexan-1-amine
CID 9120262
Cyclohexanemethylamine, N-cyclopropyl-alpha-methyl-
CID 202159
1,3,3-Trimethyl-N-(2-methylpropyl)-5-((2-methylpropyl)amino)cyclohexanemethanamine
CID 54504755
N-cyclopropyl-4-methylcyclohexan-1-amine hydrochloride
CID 45286062
Cambridge id 5458439
CID 2846443
4,4-Dimethyl-5-[(3-methylcyclohexyl)amino]pentanenitrile
CID 110209328
N-cyclopropyl-4-methylcyclohexan-1-amine
CID 16777707
cis-(1R,3S)-3-methyl-N-propan-2-ylcyclohexan-1-amine
CID 28425084
trans-(1S,3S)-3-methyl-N-propan-2-ylcyclohexan-1-amine
CID 28425088
N-ethylbicyclo[4.1.0]heptan-2-amine
CID 3060814
N-[1-(1-methylcyclopropyl)ethyl]-3-(trifluoromethyl)cyclohexan-1-amine
CID 43747428

Frequently Asked Questions

What is the IUPAC name of 3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine?
The IUPAC name of 3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine (CID 79350836) is 3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for 3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine?
The canonical SMILES for 3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine is CC1(C)C(NCC2CCCC(N)C2)C1(C)C.
What is the InChIKey of 3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine?
The InChIKey is KRZXWEABZNAXLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-13(2)12(14(13,3)4)16-9-10-6-5-7-11(15)8-10/h10-12,16H,5-9,15H2,1-4H3.
What are the key properties of 3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine?
3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine has a molecular weight of 224.39 g/mol, XLogP of 2.53, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 79350836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).