4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine

C14H27NO — CID 103901835

IUPAC4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine
SMILESCC1CCC(NC(C)C2CCOCC2)CC1
InChIInChI=1S/C14H27NO/c1-11-3-5-14(6-4-11)15-12(2)13-7-9-16-10-8-13/h11-15H,3-10H2,1-2H3
InChIKeyZILVOMXBNCFLSH-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.97
Rot. Bonds3

About 4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine

4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine (PubChem CID 103901835) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine
PubChem CID103901835
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine
SMILESCC1CCC(NC(C)C2CCOCC2)CC1
InChIInChI=1S/C14H27NO/c1-11-3-5-14(6-4-11)15-12(2)13-7-9-16-10-8-13/h11-15H,3-10H2,1-2H3
InChIKeyZILVOMXBNCFLSH-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-cyclopropylethyl]cyclopropanamine
CID 28819115
N-(1-cyclohexylethyl)oxepan-4-amine
CID 65079313
N-[1-(oxan-4-yl)ethyl]-3-propan-2-ylcyclohexan-1-amine
CID 103781048
1-[(1R,2R)-2-methylcyclohexyl]-N-[(1S)-1-(oxan-4-yl)ethyl]piperidin-4-amine
CID 97323727
N-[(1S)-1-cyclohexylethyl]-3-methylcyclopentan-1-amine
CID 81387418
1,4-dimethylcyclohexane;4-methyl-N-propan-2-ylcyclohexan-1-amine
CID 158687236
4-methyl-N-[1-(oxan-4-yl)ethyl]piperidine-1-carboxamide
CID 113258503
3-ethyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine
CID 103785689
1-methyl-N-[(1R)-1-[(3S)-oxolan-3-yl]ethyl]piperidin-4-amine
CID 99632337
N-[(1S)-1-cycloheptylethyl]cycloheptanamine
CID 81389840
N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine
CID 63478862
N-[(1R)-1-cycloheptylethyl]-4-propan-2-ylcyclohexan-1-amine
CID 81393268

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine?
The IUPAC name of 4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine (CID 103901835) is 4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine is CC1CCC(NC(C)C2CCOCC2)CC1.
What is the InChIKey of 4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine?
The InChIKey is ZILVOMXBNCFLSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-11-3-5-14(6-4-11)15-12(2)13-7-9-16-10-8-13/h11-15H,3-10H2,1-2H3.
What are the key properties of 4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine?
4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine has a molecular weight of 225.38 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[1-(oxan-4-yl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 103901835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).