5-(cyclohexylmethoxy)-N-methylpentan-2-amine

C13H27NO — CID 62382044

IUPAC5-(cyclohexylmethoxy)-N-methylpentan-2-amine
SMILESCNC(C)CCCOCC1CCCCC1
InChIInChI=1S/C13H27NO/c1-12(14-2)7-6-10-15-11-13-8-4-3-5-9-13/h12-14H,3-11H2,1-2H3
InChIKeyJOUBVGDUVDVFEO-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.97
Rot. Bonds7

About 5-(cyclohexylmethoxy)-N-methylpentan-2-amine

5-(cyclohexylmethoxy)-N-methylpentan-2-amine (PubChem CID 62382044) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 5-(cyclohexylmethoxy)-N-methylpentan-2-amine.

Molecular Properties

Compound Name5-(cyclohexylmethoxy)-N-methylpentan-2-amine
PubChem CID62382044
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name5-(cyclohexylmethoxy)-N-methylpentan-2-amine
SMILESCNC(C)CCCOCC1CCCCC1
InChIInChI=1S/C13H27NO/c1-12(14-2)7-6-10-15-11-13-8-4-3-5-9-13/h12-14H,3-11H2,1-2H3
InChIKeyJOUBVGDUVDVFEO-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(cyclohexylmethoxy)-N-propan-2-ylpropan-1-amine
CID 62343201
6-(cyclohexylmethoxy)hexan-2-amine
CID 62382043
4-cyclopentyl-N-methylbutan-2-amine
CID 61343208
(2R)-5-ethoxy-N-methylpentan-2-amine
CID 93424576
N-[2-(cyclohexylmethoxy)ethyl]-3-methylbutan-1-amine
CID 62582719
6-(2-cyclopropylethoxy)-N-methylhexan-2-amine
CID 106200767
4-(cyclohexylmethoxy)-2-(methylamino)butanamide
CID 63035501
3-methylbutoxymethylcyclobutane
CID 66602657
N-methyl-5-(3-methylbutoxy)pentan-2-amine
CID 61484601
2-(cyclooctylmethoxy)ethyl-tri(propan-2-yl)silane
CID 70179025
4-(cyclopentylmethoxy)-2-(propan-2-ylamino)butan-1-ol
CID 66324433
2-methoxyethoxymethylcyclooctane
CID 3020404

Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexylmethoxy)-N-methylpentan-2-amine?
The IUPAC name of 5-(cyclohexylmethoxy)-N-methylpentan-2-amine (CID 62382044) is 5-(cyclohexylmethoxy)-N-methylpentan-2-amine.
What is the SMILES notation for 5-(cyclohexylmethoxy)-N-methylpentan-2-amine?
The canonical SMILES for 5-(cyclohexylmethoxy)-N-methylpentan-2-amine is CNC(C)CCCOCC1CCCCC1.
What is the InChIKey of 5-(cyclohexylmethoxy)-N-methylpentan-2-amine?
The InChIKey is JOUBVGDUVDVFEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-12(14-2)7-6-10-15-11-13-8-4-3-5-9-13/h12-14H,3-11H2,1-2H3.
What are the key properties of 5-(cyclohexylmethoxy)-N-methylpentan-2-amine?
5-(cyclohexylmethoxy)-N-methylpentan-2-amine has a molecular weight of 213.36 g/mol, XLogP of 2.97, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclohexylmethoxy)-N-methylpentan-2-amine is sourced from PubChem (CID 62382044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).