2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine

C14H23NO — CID 79617048

IUPAC2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine
SMILESCCCc1ccc(C(NC)C(C)OC)cc1
InChIInChI=1S/C14H23NO/c1-5-6-12-7-9-13(10-8-12)14(15-3)11(2)16-4/h7-11,14-15H,5-6H2,1-4H3
InChIKeyPHDVCDKFUMQJQH-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.93
Rot. Bonds6

About 2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine

2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine (PubChem CID 79617048) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine
PubChem CID79617048
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine
SMILESCCCc1ccc(C(NC)C(C)OC)cc1
InChIInChI=1S/C14H23NO/c1-5-6-12-7-9-13(10-8-12)14(15-3)11(2)16-4/h7-11,14-15H,5-6H2,1-4H3
InChIKeyPHDVCDKFUMQJQH-UHFFFAOYSA-N
XLogP2.93
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 ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-methoxy-1-(4-propylphenyl)propyl]hydrazine
CID 105246822
2-methoxy-N-methyl-1-(4-propan-2-yloxyphenyl)propan-1-amine
CID 79616330
N-methyl-3-(4-propylphenyl)butan-2-amine
CID 66438296
N-methyl-1-[4-(4-propylphenyl)phenyl]ethanamine
CID 55198846
2-(3,3-dimethylbutoxy)-1-(4-ethylphenyl)-N-methylpropan-1-amine
CID 66234272
methyl 2-(4-propylphenyl)propanoate
CID 62801402
[2-cyclopropyl-2-methoxy-1-(4-propylphenyl)ethyl]hydrazine
CID 105272652
2-(methylamino)-2-(4-propylphenyl)ethanethiol
CID 116830608
2-(2,2-difluoroethoxy)-1-(4-ethylphenyl)-N-methylpropan-1-amine
CID 82004948
1-methyl-3-[(1S)-2-methyl-1-(4-propylphenyl)propyl]thiourea
CID 9284138
2-methoxy-N-methyl-1-(6-methyl-3-pyridinyl)propan-1-amine
CID 79617046
N-methyl-N'-propan-2-yl-1-(4-propylphenyl)ethane-1,2-diamine
CID 116950451

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine?
The IUPAC name of 2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine (CID 79617048) is 2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine.
What is the SMILES notation for 2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine?
The canonical SMILES for 2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine is CCCc1ccc(C(NC)C(C)OC)cc1.
What is the InChIKey of 2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine?
The InChIKey is PHDVCDKFUMQJQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-5-6-12-7-9-13(10-8-12)14(15-3)11(2)16-4/h7-11,14-15H,5-6H2,1-4H3.
What are the key properties of 2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine?
2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine has a molecular weight of 221.34 g/mol, XLogP of 2.93, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-1-(4-propylphenyl)propan-1-amine is sourced from PubChem (CID 79617048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).