4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine

C16H31N — CID 79352504

IUPAC4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine
SMILESCCC1CCC(NCC2C(C)(C)C2(C)C)CC1
InChIInChI=1S/C16H31N/c1-6-12-7-9-13(10-8-12)17-11-14-15(2,3)16(14,4)5/h12-14,17H,6-11H2,1-5H3
InChIKeyROQHKILOEKTJGH-UHFFFAOYSA-N
MW237.43 g/mol
LogP4.23
Rot. Bonds4

About 4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine

4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine (PubChem CID 79352504) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is 4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine
PubChem CID79352504
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC Name4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine
SMILESCCC1CCC(NCC2C(C)(C)C2(C)C)CC1
InChIInChI=1S/C16H31N/c1-6-12-7-9-13(10-8-12)17-11-14-15(2,3)16(14,4)5/h12-14,17H,6-11H2,1-5H3
InChIKeyROQHKILOEKTJGH-UHFFFAOYSA-N
XLogP4.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.43
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-ethyl-N-[(4-ethylcyclohexyl)methyl]cyclohexan-1-amine
CID 55192738
4-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine
CID 79352031
N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cycloheptanamine
CID 66475934
N-decyl-4-ethylcyclohexan-1-amine
CID 63492402
7-ethyl-1-N,4-N-dimethylcyclononane-1,4-diamine
CID 91593500
1-cyclopropyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]methanamine
CID 66476314
3,3-dimethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine
CID 79353545
3-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1,3-diamine
CID 79461789
4-ethyl-N-[(1-methylpyrrolidin-2-yl)methyl]cyclohexan-1-amine
CID 103626242
4-ethyl-1-[[(4-ethylcyclohexyl)amino]methyl]cyclohexan-1-ol
CID 65116333
3-[[(4-ethylcycloheptyl)amino]methyl]cyclopentan-1-ol
CID 114146190
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-ethylcyclohexan-1-amine
CID 54920980

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine?
The IUPAC name of 4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine (CID 79352504) is 4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine?
The canonical SMILES for 4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine is CCC1CCC(NCC2C(C)(C)C2(C)C)CC1.
What is the InChIKey of 4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine?
The InChIKey is ROQHKILOEKTJGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c1-6-12-7-9-13(10-8-12)17-11-14-15(2,3)16(14,4)5/h12-14,17H,6-11H2,1-5H3.
What are the key properties of 4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine?
4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine has a molecular weight of 237.43 g/mol, XLogP of 4.23, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 79352504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).