N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine

C17H33N — CID 63478862

IUPACN-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine
SMILESCC(C)C1CCC(NC(C)C2CCCCC2)CC1
InChIInChI=1S/C17H33N/c1-13(2)15-9-11-17(12-10-15)18-14(3)16-7-5-4-6-8-16/h13-18H,4-12H2,1-3H3
InChIKeyYLENKMHTDVJCPA-UHFFFAOYSA-N
MW251.46 g/mol
LogP4.76
Rot. Bonds4

About N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine

N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine (PubChem CID 63478862) has the molecular formula C17H33N and a molecular weight of 251.46 g/mol. Its IUPAC name is N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine.

Molecular Properties

Compound NameN-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine
PubChem CID63478862
Molecular FormulaC17H33N
Molecular Weight251.46 g/mol
Exact Mass251.26
IUPAC NameN-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine
SMILESCC(C)C1CCC(NC(C)C2CCCCC2)CC1
InChIInChI=1S/C17H33N/c1-13(2)15-9-11-17(12-10-15)18-14(3)16-7-5-4-6-8-16/h13-18H,4-12H2,1-3H3
InChIKeyYLENKMHTDVJCPA-UHFFFAOYSA-N
XLogP4.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.46
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1R)-1-cycloheptylethyl]-4-propan-2-ylcyclohexan-1-amine
CID 81393268
N-[(1S)-1-cycloheptylethyl]-4-propan-2-ylcycloheptan-1-amine
CID 81389643
N-(1-cyclohexylethyl)-4-propan-2-ylcycloheptan-1-amine
CID 65091327
N-(1-cyclopropylethyl)cyclohexanamine
CID 43177177
N-[(1S)-1-cycloheptylethyl]cycloheptanamine
CID 81389840
N-[(1R)-1-cyclopropylethyl]cyclopropanamine
CID 28819115
4-N-[(1R)-1-cyclohexylethyl]cyclohexane-1,4-diamine
CID 81385078
N-[(1R)-1-cycloheptylethyl]piperidin-4-amine
CID 81391963
N-[(1S)-1-cyclohexylethyl]-3-methylcyclopentan-1-amine
CID 81387418
4-(1-cyclobutylethylamino)cyclohexan-1-ol
CID 103775411
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-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine?
The IUPAC name of N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine (CID 63478862) is N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine.
What is the SMILES notation for N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine?
The canonical SMILES for N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine is CC(C)C1CCC(NC(C)C2CCCCC2)CC1.
What is the InChIKey of N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine?
The InChIKey is YLENKMHTDVJCPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N/c1-13(2)15-9-11-17(12-10-15)18-14(3)16-7-5-4-6-8-16/h13-18H,4-12H2,1-3H3.
What are the key properties of N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine?
N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine has a molecular weight of 251.46 g/mol, XLogP of 4.76, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine is sourced from PubChem (CID 63478862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).