1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine

C16H26N2O — CID 43315083

IUPAC1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(c2cc(C)ccc2OC)CC1
InChIInChI=1S/C16H26N2O/c1-4-9-17-14-7-10-18(11-8-14)15-12-13(2)5-6-16(15)19-3/h5-6,12,14,17H,4,7-11H2,1-3H3
InChIKeyLNXUQKQXLOZFBE-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.97
Rot. Bonds5

About 1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine

1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine (PubChem CID 43315083) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine
PubChem CID43315083
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(c2cc(C)ccc2OC)CC1
InChIInChI=1S/C16H26N2O/c1-4-9-17-14-7-10-18(11-8-14)15-12-13(2)5-6-16(15)19-3/h5-6,12,14,17H,4,7-11H2,1-3H3
InChIKeyLNXUQKQXLOZFBE-UHFFFAOYSA-N
XLogP2.97
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2-methoxy-5-methylphenyl)methyl]-N-propylpiperidin-4-amine
CID 62155983
1-(4-chloro-2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine
CID 60861458
1-(5-chloro-2,4-dimethoxyphenyl)-N-propylpiperidin-4-amine
CID 60861288
1-(2,5-dimethylphenyl)-N-propylpyrrolidin-3-amine
CID 43314896
1-(3,5-dimethoxyphenyl)-N-propylpiperidin-4-amine
CID 43315050
1-(3-methylphenyl)-N-propylpiperidin-4-amine
CID 43315485
1-(2-methoxy-5-methylphenyl)-4-methylpiperazine
CID 20811370
2-[[1-(2-methoxyphenyl)piperidin-4-yl]amino]ethanol
CID 166899340
2-[[1-(2-methoxyphenyl)piperidin-4-yl]amino]ethylcarbamic acid
CID 22615426
1-(2,5-dimethoxyphenyl)-N-methylpiperidin-4-amine
CID 43315071
4,7-dimethoxy-N-propyl-2,3-dihydro-1H-inden-2-amine
CID 12773157
1-(3-bromo-2-methylphenyl)-N-propylpiperidin-4-amine
CID 107636284

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine?
The IUPAC name of 1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine (CID 43315083) is 1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine.
What is the SMILES notation for 1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine?
The canonical SMILES for 1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine is CCCNC1CCN(c2cc(C)ccc2OC)CC1.
What is the InChIKey of 1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine?
The InChIKey is LNXUQKQXLOZFBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-4-9-17-14-7-10-18(11-8-14)15-12-13(2)5-6-16(15)19-3/h5-6,12,14,17H,4,7-11H2,1-3H3.
What are the key properties of 1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine?
1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine has a molecular weight of 262.40 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-5-methylphenyl)-N-propylpiperidin-4-amine is sourced from PubChem (CID 43315083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).