N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine

C18H35N — CID 81030772

IUPACN-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1CCC(C(C)(C)C)CC1C1CC1
InChIInChI=1S/C18H35N/c1-17(2,3)15-10-9-14(12-19-18(4,5)6)16(11-15)13-7-8-13/h13-16,19H,7-12H2,1-6H3
InChIKeyDFUSTBCKQCDZEM-UHFFFAOYSA-N
MW265.48 g/mol
LogP4.86
Rot. Bonds3

About N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine

N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine (PubChem CID 81030772) has the molecular formula C18H35N and a molecular weight of 265.48 g/mol. Its IUPAC name is N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine
PubChem CID81030772
Molecular FormulaC18H35N
Molecular Weight265.48 g/mol
Exact Mass265.28
IUPAC NameN-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1CCC(C(C)(C)C)CC1C1CC1
InChIInChI=1S/C18H35N/c1-17(2,3)15-10-9-14(12-19-18(4,5)6)16(11-15)13-7-8-13/h13-16,19H,7-12H2,1-6H3
InChIKeyDFUSTBCKQCDZEM-UHFFFAOYSA-N
XLogP4.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.48
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[2-(4-tert-butylcyclohexyl)cyclopropyl]methyl]-2-methylpropan-2-amine
CID 104575933
N-[(4-tert-butyl-2-cyclopentylcyclohexyl)methyl]ethanamine
CID 81031059
N-[[4-tert-butyl-2-(ethoxymethyl)cyclohexyl]methyl]-2-methylpropan-2-amine
CID 81030544
N-[[4-tert-butyl-2-(2-methylbutyl)cyclohexyl]methyl]-2-methylpropan-2-amine
CID 81021871
N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine
CID 81025228
N-[[4-ethyl-2-(oxan-4-yl)cyclohexyl]methyl]-2-methylpropan-2-amine
CID 81029514
2-methyl-N-[[2-(oxan-4-yl)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine
CID 81026173
N-[[2-(4-tert-butylcyclohexyl)cyclopropyl]methyl]propan-2-amine
CID 104575931
N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine
CID 81028892
[4-tert-butyl-2-(oxan-4-yl)cyclohexyl]methanamine
CID 81011372
2-methyl-N-[[2-(3-methylcyclohexyl)cyclopentyl]methyl]propan-2-amine
CID 81026999
N-[(2-tert-butyl-4-ethylcyclohexyl)methyl]-2-methylpropan-2-amine
CID 81030105

Frequently Asked Questions

What is the IUPAC name of N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine (CID 81030772) is N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine is CC(C)(C)NCC1CCC(C(C)(C)C)CC1C1CC1.
What is the InChIKey of N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine?
The InChIKey is DFUSTBCKQCDZEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N/c1-17(2,3)15-10-9-14(12-19-18(4,5)6)16(11-15)13-7-8-13/h13-16,19H,7-12H2,1-6H3.
What are the key properties of N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine?
N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine has a molecular weight of 265.48 g/mol, XLogP of 4.86, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 81030772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).