2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine

C13H25NO — CID 62384942

IUPAC2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine
SMILESCC1CCCCC1NCC1CCOCC1
InChIInChI=1S/C13H25NO/c1-11-4-2-3-5-13(11)14-10-12-6-8-15-9-7-12/h11-14H,2-10H2,1H3
InChIKeyFGEGZAOWJSRXQG-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.58
Rot. Bonds3

About 2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine

2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine (PubChem CID 62384942) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine
PubChem CID62384942
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine
SMILESCC1CCCCC1NCC1CCOCC1
InChIInChI=1S/C13H25NO/c1-11-4-2-3-5-13(11)14-10-12-6-8-15-9-7-12/h11-14H,2-10H2,1H3
InChIKeyFGEGZAOWJSRXQG-UHFFFAOYSA-N
XLogP2.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-N-(oxan-4-ylmethyl)thiolan-3-amine
CID 130519839
[2-(oxan-4-ylmethylamino)cyclohexyl]methanol
CID 115685723
2,4,4-trimethyl-N-(oxan-4-ylmethyl)cyclopentan-1-amine
CID 106662513
N-(oxan-4-ylmethyl)cycloheptanamine
CID 61269563
N-(oxan-4-ylmethyl)cyclohexanamine
CID 61269562
2-methyl-N-(oxan-2-ylmethyl)cyclopentan-1-amine
CID 63278391
2-methylsulfonyl-N-(oxan-4-ylmethyl)cyclopentan-1-amine
CID 65045602
2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine
CID 107417002
2-methyl-N-(piperidin-3-ylmethyl)cyclohexan-1-amine
CID 80553082
tert-butyl N-[[2-(oxan-4-ylmethylamino)cyclohexyl]methyl]carbamate
CID 103695505
2-methyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine
CID 79082849
2-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine
CID 4711849

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine?
The IUPAC name of 2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine (CID 62384942) is 2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for 2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for 2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine is CC1CCCCC1NCC1CCOCC1.
What is the InChIKey of 2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine?
The InChIKey is FGEGZAOWJSRXQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-11-4-2-3-5-13(11)14-10-12-6-8-15-9-7-12/h11-14H,2-10H2,1H3.
What are the key properties of 2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine?
2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine has a molecular weight of 211.35 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(oxan-4-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 62384942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).