N-ethyl-2-methoxy-2,8-dimethylnonan-5-amine

C14H31NO — CID 103031181

IUPACN-ethyl-2-methoxy-2,8-dimethylnonan-5-amine
SMILESCCNC(CCC(C)C)CCC(C)(C)OC
InChIInChI=1S/C14H31NO/c1-7-15-13(9-8-12(2)3)10-11-14(4,5)16-6/h12-13,15H,7-11H2,1-6H3
InChIKeyRJTVICVNKXGKFX-UHFFFAOYSA-N
MW229.41 g/mol
LogP3.61
Rot. Bonds9

About N-ethyl-2-methoxy-2,8-dimethylnonan-5-amine

N-ethyl-2-methoxy-2,8-dimethylnonan-5-amine (PubChem CID 103031181) has the molecular formula C14H31NO and a molecular weight of 229.41 g/mol. Its IUPAC name is N-ethyl-2-methoxy-2,8-dimethylnonan-5-amine.

Molecular Properties

Compound NameN-ethyl-2-methoxy-2,8-dimethylnonan-5-amine
PubChem CID103031181
Molecular FormulaC14H31NO
Molecular Weight229.41 g/mol
Exact Mass229.24
IUPAC NameN-ethyl-2-methoxy-2,8-dimethylnonan-5-amine
SMILESCCNC(CCC(C)C)CCC(C)(C)OC
InChIInChI=1S/C14H31NO/c1-7-15-13(9-8-12(2)3)10-11-14(4,5)16-6/h12-13,15H,7-11H2,1-6H3
InChIKeyRJTVICVNKXGKFX-UHFFFAOYSA-N
XLogP3.61
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.41
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 103028745
CID 103028745
CID 103031103
CID 103031103
CID 103025039
CID 103025039
CID 103025040
CID 103025040
CID 103025042
CID 103025042
CID 103025050
CID 103025050
CID 103025053
CID 103025053
CID 103025055
CID 103025055
CID 103025057
CID 103025057
CID 103025058
CID 103025058
CID 103025059
CID 103025059
CID 103025061
CID 103025061

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-2,8-dimethylnonan-5-amine?
The IUPAC name of N-ethyl-2-methoxy-2,8-dimethylnonan-5-amine (CID 103031181) is N-ethyl-2-methoxy-2,8-dimethylnonan-5-amine.
What is the SMILES notation for N-ethyl-2-methoxy-2,8-dimethylnonan-5-amine?
The canonical SMILES for N-ethyl-2-methoxy-2,8-dimethylnonan-5-amine is CCNC(CCC(C)C)CCC(C)(C)OC.
What is the InChIKey of N-ethyl-2-methoxy-2,8-dimethylnonan-5-amine?
The InChIKey is RJTVICVNKXGKFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO/c1-7-15-13(9-8-12(2)3)10-11-14(4,5)16-6/h12-13,15H,7-11H2,1-6H3.
What are the key properties of N-ethyl-2-methoxy-2,8-dimethylnonan-5-amine?
N-ethyl-2-methoxy-2,8-dimethylnonan-5-amine has a molecular weight of 229.41 g/mol, XLogP of 3.61, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-2,8-dimethylnonan-5-amine is sourced from PubChem (CID 103031181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).