1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine

C14H23NO — CID 61065170

IUPAC1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine
SMILESCNC(Cc1ccc(OC)cc1)CC(C)C
InChIInChI=1S/C14H23NO/c1-11(2)9-13(15-3)10-12-5-7-14(16-4)8-6-12/h5-8,11,13,15H,9-10H2,1-4H3
InChIKeyMNBJQXIDJSKVDQ-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.87
Rot. Bonds6

About 1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine

1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine (PubChem CID 61065170) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine
PubChem CID61065170
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine
SMILESCNC(Cc1ccc(OC)cc1)CC(C)C
InChIInChI=1S/C14H23NO/c1-11(2)9-13(15-3)10-12-5-7-14(16-4)8-6-12/h5-8,11,13,15H,9-10H2,1-4H3
InChIKeyMNBJQXIDJSKVDQ-UHFFFAOYSA-N
XLogP2.87
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methoxyphenyl)-N-methyldecan-2-amine
CID 63416962
1-(2-chloro-4-methylpentyl)-4-methoxybenzene
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1-(4-methoxyphenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]methanamine
CID 43480574
1-(2,5-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-2-amine
CID 61481786
1-(4-methoxyphenyl)-N-methyl-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107048734
6,6,6-trifluoro-1-(4-methoxyphenyl)-N-methylhexan-2-amine
CID 115516486
N-[1-(4-methoxyphenyl)propan-2-yl]-4-methylpentan-1-amine
CID 54914161
N-ethyl-1-(4-methoxyphenyl)-5-methylhexan-2-amine
CID 61066425
N-(1-bromo-4-methylpentan-2-yl)-2-(4-methoxyphenyl)acetamide
CID 114311652
1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine
CID 61066103
1-(4-methoxyphenyl)propane-2-thiol
CID 63272833
1-methoxy-4-[(2R)-2-methoxypropyl]benzene
CID 138984863

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine?
The IUPAC name of 1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine (CID 61065170) is 1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine.
What is the SMILES notation for 1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine?
The canonical SMILES for 1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine is CNC(Cc1ccc(OC)cc1)CC(C)C.
What is the InChIKey of 1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine?
The InChIKey is MNBJQXIDJSKVDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-11(2)9-13(15-3)10-12-5-7-14(16-4)8-6-12/h5-8,11,13,15H,9-10H2,1-4H3.
What are the key properties of 1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine?
1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine has a molecular weight of 221.34 g/mol, XLogP of 2.87, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N,4-dimethylpentan-2-amine is sourced from PubChem (CID 61065170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).