7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine

C17H29NO — CID 103032342

IUPAC7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine
SMILESCNC(CCCc1ccccc1)CCC(C)(C)OC
InChIInChI=1S/C17H29NO/c1-17(2,19-4)14-13-16(18-3)12-8-11-15-9-6-5-7-10-15/h5-7,9-10,16,18H,8,11-14H2,1-4H3
InChIKeyWLQQKAAPDYYGSU-UHFFFAOYSA-N
MW263.43 g/mol
LogP3.80
Rot. Bonds9

About 7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine

7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine (PubChem CID 103032342) has the molecular formula C17H29NO and a molecular weight of 263.43 g/mol. Its IUPAC name is 7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine.

Molecular Properties

Compound Name7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine
PubChem CID103032342
Molecular FormulaC17H29NO
Molecular Weight263.43 g/mol
Exact Mass263.22
IUPAC Name7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine
SMILESCNC(CCCc1ccccc1)CCC(C)(C)OC
InChIInChI=1S/C17H29NO/c1-17(2,19-4)14-13-16(18-3)12-8-11-15-9-6-5-7-10-15/h5-7,9-10,16,18H,8,11-14H2,1-4H3
InChIKeyWLQQKAAPDYYGSU-UHFFFAOYSA-N
XLogP3.80
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methoxy-N-methyl-6-phenylhexan-3-amine
CID 62605190
5-methoxy-N,5-dimethyl-1-phenoxyhexan-2-amine
CID 103031640
6-methoxy-N,6-dimethyl-1-(3-methylphenyl)heptan-3-amine
CID 103032202
2-methoxy-N,2-dimethylnonan-5-amine
CID 103031216
6-methoxy-N-methyl-1-phenylhexan-3-amine
CID 62602732
N-methyl-1,5-diphenylpentan-3-amine
CID 10586995
7-methoxy-N,7-dimethyloctan-4-amine
CID 103031355
2,7-dimethoxy-N,2,7-trimethyloctan-4-amine
CID 103031280
1-cyclohexyl-N-methyl-6-phenylhexan-3-amine
CID 115849338
N-methyl-5-phenyl-1-propan-2-ylsulfanylpentan-2-amine
CID 65131659
8-methoxy-N,8-dimethylnonan-4-amine
CID 103034544
N-methyl-6-phenyl-1-pyridin-3-ylhexan-3-amine
CID 105139816

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine?
The IUPAC name of 7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine (CID 103032342) is 7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine.
What is the SMILES notation for 7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine?
The canonical SMILES for 7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine is CNC(CCCc1ccccc1)CCC(C)(C)OC.
What is the InChIKey of 7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine?
The InChIKey is WLQQKAAPDYYGSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29NO/c1-17(2,19-4)14-13-16(18-3)12-8-11-15-9-6-5-7-10-15/h5-7,9-10,16,18H,8,11-14H2,1-4H3.
What are the key properties of 7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine?
7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine has a molecular weight of 263.43 g/mol, XLogP of 3.80, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N,7-dimethyl-1-phenyloctan-4-amine is sourced from PubChem (CID 103032342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).