2-methoxy-N,7-dimethylnonan-3-amine

C12H27NO — CID 123313653

IUPAC2-methoxy-N,7-dimethylnonan-3-amine
SMILESCCC(C)CCCC(NC)C(C)OC
InChIInChI=1S/C12H27NO/c1-6-10(2)8-7-9-12(13-4)11(3)14-5/h10-13H,6-9H2,1-5H3
InChIKeyHNXLRFAFSXOEOQ-UHFFFAOYSA-N
MW201.35 g/mol
LogP2.83
Rot. Bonds8

About 2-methoxy-N,7-dimethylnonan-3-amine

2-methoxy-N,7-dimethylnonan-3-amine (PubChem CID 123313653) has the molecular formula C12H27NO and a molecular weight of 201.35 g/mol. Its IUPAC name is 2-methoxy-N,7-dimethylnonan-3-amine.

Molecular Properties

Compound Name2-methoxy-N,7-dimethylnonan-3-amine
PubChem CID123313653
Molecular FormulaC12H27NO
Molecular Weight201.35 g/mol
Exact Mass201.21
IUPAC Name2-methoxy-N,7-dimethylnonan-3-amine
SMILESCCC(C)CCCC(NC)C(C)OC
InChIInChI=1S/C12H27NO/c1-6-10(2)8-7-9-12(13-4)11(3)14-5/h10-13H,6-9H2,1-5H3
InChIKeyHNXLRFAFSXOEOQ-UHFFFAOYSA-N
XLogP2.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.35
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-Ethyl-1-piperidin-2-ylpentyl) hypofluorite
CID 144738728
(2S,3S,4S,5R)-4-fluoro-N-methyl-5-(2-methylpropyl)-2-propan-2-yloxolan-3-amine
CID 176612956
2-cycloheptyl-2-(difluoromethoxy)-N-methylethanamine
CID 84724792
1-cycloheptyl-2-(difluoromethoxy)-N-methylethanamine
CID 84724795
1-cyclohexyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methylethanamine
CID 102721932
1-cyclopentyl-N-methyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
CID 104749591
N-[1-cyclohexyl-2-(1,1,1-trifluoropropan-2-yloxy)ethyl]propan-1-amine
CID 104749593
2-methoxy-N-methyl-1-[4-(trifluoromethyl)cyclohexyl]ethanamine
CID 105165724
1-(4,4-difluorocyclohexyl)-N-ethyl-2-propan-2-yloxyethanamine
CID 105168103
N-ethyl-2-propan-2-yloxy-1-[4-(trifluoromethyl)cyclohexyl]ethanamine
CID 105168135
1-(4,4-difluorocyclohexyl)-N-methyl-2-propan-2-yloxyethanamine
CID 105168239
N-methyl-2-propan-2-yloxy-1-[4-(trifluoromethyl)cyclohexyl]ethanamine
CID 105168281

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N,7-dimethylnonan-3-amine?
The IUPAC name of 2-methoxy-N,7-dimethylnonan-3-amine (CID 123313653) is 2-methoxy-N,7-dimethylnonan-3-amine.
What is the SMILES notation for 2-methoxy-N,7-dimethylnonan-3-amine?
The canonical SMILES for 2-methoxy-N,7-dimethylnonan-3-amine is CCC(C)CCCC(NC)C(C)OC.
What is the InChIKey of 2-methoxy-N,7-dimethylnonan-3-amine?
The InChIKey is HNXLRFAFSXOEOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO/c1-6-10(2)8-7-9-12(13-4)11(3)14-5/h10-13H,6-9H2,1-5H3.
What are the key properties of 2-methoxy-N,7-dimethylnonan-3-amine?
2-methoxy-N,7-dimethylnonan-3-amine has a molecular weight of 201.35 g/mol, XLogP of 2.83, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,7-dimethylnonan-3-amine is sourced from PubChem (CID 123313653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).