2-cyclohexyl-2-(methoxymethyl)pentan-1-amine

C13H27NO — CID 139927573

IUPAC2-cyclohexyl-2-(methoxymethyl)pentan-1-amine
SMILESCCCC(CN)(COC)C1CCCCC1
InChIInChI=1S/C13H27NO/c1-3-9-13(10-14,11-15-2)12-7-5-4-6-8-12/h12H,3-11,14H2,1-2H3
InChIKeyINDPWPCYMJFWIX-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.96
Rot. Bonds6

About 2-cyclohexyl-2-(methoxymethyl)pentan-1-amine

2-cyclohexyl-2-(methoxymethyl)pentan-1-amine (PubChem CID 139927573) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 2-cyclohexyl-2-(methoxymethyl)pentan-1-amine.

Molecular Properties

Compound Name2-cyclohexyl-2-(methoxymethyl)pentan-1-amine
PubChem CID139927573
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name2-cyclohexyl-2-(methoxymethyl)pentan-1-amine
SMILESCCCC(CN)(COC)C1CCCCC1
InChIInChI=1S/C13H27NO/c1-3-9-13(10-14,11-15-2)12-7-5-4-6-8-12/h12H,3-11,14H2,1-2H3
InChIKeyINDPWPCYMJFWIX-UHFFFAOYSA-N
XLogP2.96
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-2-(methoxymethyl)butan-1-amine
CID 139927552
2-cyclopentyl-2-(methoxymethyl)-4-methylpentan-1-amine
CID 139968950
[4-cyclohexyl-1-methoxy-2-(methoxymethyl)butan-2-yl]cyclohexane
CID 71344559
[5-bromo-1-methoxy-2-(methoxymethyl)-7-methyl-5-(2-methylpropyl)octan-2-yl]cyclohexane
CID 174162182
2-cyclopentyl-2-(methoxymethyl)-3-methylbutan-1-amine
CID 139927528
(1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane
CID 89106500
2-(aminomethyl)-2-cycloheptylpentanoic acid
CID 106488140
(2-cyclohexyl-2-ethylbutoxy)silane
CID 123574003
(4-ethyl-6,6-dimethyloctan-4-yl)cyclopentane
CID 123410330
2-cycloheptyl-2-methylpropan-1-amine
CID 82934909
2-cyclohexyl-2-methylpropan-1-amine
CID 19776368
2-(methoxymethyl)-2-methylpentan-1-amine
CID 103984443

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2-(methoxymethyl)pentan-1-amine?
The IUPAC name of 2-cyclohexyl-2-(methoxymethyl)pentan-1-amine (CID 139927573) is 2-cyclohexyl-2-(methoxymethyl)pentan-1-amine.
What is the SMILES notation for 2-cyclohexyl-2-(methoxymethyl)pentan-1-amine?
The canonical SMILES for 2-cyclohexyl-2-(methoxymethyl)pentan-1-amine is CCCC(CN)(COC)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-2-(methoxymethyl)pentan-1-amine?
The InChIKey is INDPWPCYMJFWIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-3-9-13(10-14,11-15-2)12-7-5-4-6-8-12/h12H,3-11,14H2,1-2H3.
What are the key properties of 2-cyclohexyl-2-(methoxymethyl)pentan-1-amine?
2-cyclohexyl-2-(methoxymethyl)pentan-1-amine has a molecular weight of 213.36 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2-(methoxymethyl)pentan-1-amine is sourced from PubChem (CID 139927573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).