N-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine

C18H35N — CID 103961036

IUPACN-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine
SMILESC[C@H](NC1CC(C)(C)CC(C)(C)C1)C1CCCCC1
InChIInChI=1S/C18H35N/c1-14(15-9-7-6-8-10-15)19-16-11-17(2,3)13-18(4,5)12-16/h14-16,19H,6-13H2,1-5H3/t14-/m0/s1
InChIKeyWFTYVSCIPMSKHT-AWEZNQCLSA-N
MW265.48 g/mol
LogP5.15
Rot. Bonds3

About N-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine

N-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine (PubChem CID 103961036) has the molecular formula C18H35N and a molecular weight of 265.48 g/mol. Its IUPAC name is N-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine
PubChem CID103961036
Molecular FormulaC18H35N
Molecular Weight265.48 g/mol
Exact Mass265.28
IUPAC NameN-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine
SMILESC[C@H](NC1CC(C)(C)CC(C)(C)C1)C1CCCCC1
InChIInChI=1S/C18H35N/c1-14(15-9-7-6-8-10-15)19-16-11-17(2,3)13-18(4,5)12-16/h14-16,19H,6-13H2,1-5H3/t14-/m0/s1
InChIKeyWFTYVSCIPMSKHT-AWEZNQCLSA-N
XLogP5.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.48
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1R)-1-cyclopentylethyl]-3,3-dimethylcyclopentan-1-amine
CID 81395492
3,3,5,5-tetramethyl-N-[1-(1-methylpiperidin-3-yl)ethyl]cyclohexan-1-amine
CID 115923462
N-[(1S)-1-cycloheptylethyl]cycloheptanamine
CID 81389840
N-(1-cyclopentylethyl)-2,2,3,3-tetramethylcyclopropan-1-amine
CID 79359064
N-[1-(1-ethylpiperidin-3-yl)ethyl]-3,3,5,5-tetramethylcyclohexan-1-amine
CID 103965774
N-(1-cyclopropylethyl)cyclohexanamine
CID 43177177
3,3,5,5-tetramethyl-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine
CID 112681915
N-[(1R)-1-cycloheptylethyl]piperidin-4-amine
CID 81391963
N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine
CID 63478862
N-[(1R)-1-cycloheptylethyl]-4-propan-2-ylcyclohexan-1-amine
CID 81393268
N-[(1S)-1-cyclohexylethyl]oxetan-3-amine
CID 81388066
N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine
CID 115677489

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine?
The IUPAC name of N-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine (CID 103961036) is N-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine.
What is the SMILES notation for N-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine?
The canonical SMILES for N-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine is C[C@H](NC1CC(C)(C)CC(C)(C)C1)C1CCCCC1.
What is the InChIKey of N-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine?
The InChIKey is WFTYVSCIPMSKHT-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H35N/c1-14(15-9-7-6-8-10-15)19-16-11-17(2,3)13-18(4,5)12-16/h14-16,19H,6-13H2,1-5H3/t14-/m0/s1.
What are the key properties of N-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine?
N-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine has a molecular weight of 265.48 g/mol, XLogP of 5.15, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-cyclohexylethyl]-3,3,5,5-tetramethylcyclohexan-1-amine is sourced from PubChem (CID 103961036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).