N,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine

C15H31NO — CID 88680595

IUPACN,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine
SMILESCCN(C=CC(C)CCCC(C)(C)OC)CC
InChIInChI=1S/C15H31NO/c1-7-16(8-2)13-11-14(3)10-9-12-15(4,5)17-6/h11,13-14H,7-10,12H2,1-6H3
InChIKeyYIZAHTMRGWDDJC-UHFFFAOYSA-N
MW241.42 g/mol
LogP4.07
Rot. Bonds9

About N,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine

N,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine (PubChem CID 88680595) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is N,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine.

Molecular Properties

Compound NameN,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine
PubChem CID88680595
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC NameN,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine
SMILESCCN(C=CC(C)CCCC(C)(C)OC)CC
InChIInChI=1S/C15H31NO/c1-7-16(8-2)13-11-14(3)10-9-12-15(4,5)17-6/h11,13-14H,7-10,12H2,1-6H3
InChIKeyYIZAHTMRGWDDJC-UHFFFAOYSA-N
XLogP4.07
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 6-methoxy-2,6-dimethylheptanoate
CID 118230502
7-bromo-2-methoxy-2,8-dimethylnonane
CID 103037609
7-methoxy-N,7-dimethyloctan-3-amine
CID 103034550
7-methoxy-3,7-dimethyloctan-1-amine
CID 102547373
8-methoxy-N,8-dimethylnonan-4-amine
CID 103034544
(3S)-N,N-diethyl-3,7,11-trimethyldodeca-1,6,10-trien-1-amine
CID 123394667
methyl 2-[(3-methoxy-3-methylbutyl)amino]propanoate
CID 103033239
6-methoxy-2,6-dimethyl-N-(2-methylpropyl)heptan-1-amine
CID 103019805
5-[(3-methoxy-3-methylbutyl)amino]pentan-2-ol
CID 106122501
dimethyl 2-(3-methoxy-3-methylbutyl)propanedioate
CID 103023222
10-methoxy-2,10-dimethylundecanoic acid
CID 138478645
2-[(3-methoxy-3-methylbutyl)amino]propan-1-ol
CID 103019922

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine?
The IUPAC name of N,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine (CID 88680595) is N,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine.
What is the SMILES notation for N,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine?
The canonical SMILES for N,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine is CCN(C=CC(C)CCCC(C)(C)OC)CC.
What is the InChIKey of N,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine?
The InChIKey is YIZAHTMRGWDDJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-7-16(8-2)13-11-14(3)10-9-12-15(4,5)17-6/h11,13-14H,7-10,12H2,1-6H3.
What are the key properties of N,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine?
N,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine has a molecular weight of 241.42 g/mol, XLogP of 4.07, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-7-methoxy-3,7-dimethyloct-1-en-1-amine is sourced from PubChem (CID 88680595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).