4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine

C18H37NO — CID 63505523

IUPAC4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine
SMILESCC(C)CCCNCCOC1CC(C)CCC1C(C)C
InChIInChI=1S/C18H37NO/c1-14(2)7-6-10-19-11-12-20-18-13-16(5)8-9-17(18)15(3)4/h14-19H,6-13H2,1-5H3
InChIKeyWAAHQVLGXUREMH-UHFFFAOYSA-N
MW283.50 g/mol
LogP4.49
Rot. Bonds9

About 4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine

4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine (PubChem CID 63505523) has the molecular formula C18H37NO and a molecular weight of 283.50 g/mol. Its IUPAC name is 4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine.

Molecular Properties

Compound Name4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine
PubChem CID63505523
Molecular FormulaC18H37NO
Molecular Weight283.50 g/mol
Exact Mass283.29
IUPAC Name4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine
SMILESCC(C)CCCNCCOC1CC(C)CCC1C(C)C
InChIInChI=1S/C18H37NO/c1-14(2)7-6-10-19-11-12-20-18-13-16(5)8-9-17(18)15(3)4/h14-19H,6-13H2,1-5H3
InChIKeyWAAHQVLGXUREMH-UHFFFAOYSA-N
XLogP4.49
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.50
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-methoxyethyl)-3-(5-methyl-2-propan-2-ylcyclohexyl)oxypropan-1-amine
CID 55088056
N-(cyclopropylmethyl)-2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanamine
CID 62572050
N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-2-amine
CID 55194368
4-methyl-1-propan-2-yl-2-propoxycyclohexane
CID 54499043
3-(5-methyl-2-propan-2-ylcyclohexyl)oxypropan-1-ol
CID 16734861
1-cyclopropyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]ethanamine
CID 55088055
N-methyl-6-(5-methyl-2-propan-2-ylcyclohexyl)oxyhexan-3-amine
CID 106800782
(1S,2R,4R)-2-(2-bromoethoxy)-4-methyl-1-propan-2-ylcyclohexane
CID 22883721
2-[(2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxyethanol
CID 11651336
2-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxyethanethiol
CID 131866620
N-tert-butyl-4-(5-methyl-2-propan-2-ylcyclohexyl)oxybutan-1-amine
CID 62445917
5-(5-methyl-2-propan-2-ylcyclohexyl)oxypentan-1-amine
CID 54966296

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine?
The IUPAC name of 4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine (CID 63505523) is 4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine.
What is the SMILES notation for 4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine?
The canonical SMILES for 4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine is CC(C)CCCNCCOC1CC(C)CCC1C(C)C.
What is the InChIKey of 4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine?
The InChIKey is WAAHQVLGXUREMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37NO/c1-14(2)7-6-10-19-11-12-20-18-13-16(5)8-9-17(18)15(3)4/h14-19H,6-13H2,1-5H3.
What are the key properties of 4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine?
4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine has a molecular weight of 283.50 g/mol, XLogP of 4.49, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethyl]pentan-1-amine is sourced from PubChem (CID 63505523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).