N-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine

C16H26N2O — CID 60807135

IUPACN-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine
SMILESCCN(Cc1cc(C)ccc1OC)C1CCNCC1
InChIInChI=1S/C16H26N2O/c1-4-18(15-7-9-17-10-8-15)12-14-11-13(2)5-6-16(14)19-3/h5-6,11,15,17H,4,7-10,12H2,1-3H3
InChIKeyVAPRZUGDWNWGQD-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.58
Rot. Bonds5

About N-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine

N-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine (PubChem CID 60807135) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine
PubChem CID60807135
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine
SMILESCCN(Cc1cc(C)ccc1OC)C1CCNCC1
InChIInChI=1S/C16H26N2O/c1-4-18(15-7-9-17-10-8-15)12-14-11-13(2)5-6-16(14)19-3/h5-6,11,15,17H,4,7-10,12H2,1-3H3
InChIKeyVAPRZUGDWNWGQD-UHFFFAOYSA-N
XLogP2.58
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 ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[cyclopropyl(ethyl)amino]methyl]-4-methoxyaniline
CID 43263758
4-[(2-methoxy-5-methylphenyl)methoxy]piperidine
CID 62159793
1-[3-[[ethyl(pyrrolidin-3-yl)amino]methyl]-4-methoxyphenyl]ethanone
CID 63299582
4-[(2-methoxy-5-methylphenyl)methoxymethyl]piperidine
CID 55060565
N-[(4-bromo-2,5-dimethoxyphenyl)methyl]-N-ethylpyrrolidin-3-amine
CID 63300212
4-N-ethyl-4-N-[(5-fluoro-2-methoxyphenyl)methyl]cyclohexane-1,4-diamine
CID 79115454
2-[[cyclopentyl(ethyl)amino]methyl]-4-methylphenol
CID 82976860
5-[[ethyl(pyrrolidin-3-yl)amino]methyl]-2-methoxyphenol
CID 55204949
N-(2-methoxy-5-methylphenyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
CID 119932950
4-[[ethyl(pyrrolidin-3-yl)amino]methyl]-2-methoxyphenol
CID 55204759
N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-1-piperidin-3-ylmethanamine
CID 103815655
methyl 3-[[ethyl(piperidin-4-yl)amino]methyl]furan-2-carboxylate
CID 60806955

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine?
The IUPAC name of N-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine (CID 60807135) is N-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine.
What is the SMILES notation for N-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine?
The canonical SMILES for N-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine is CCN(Cc1cc(C)ccc1OC)C1CCNCC1.
What is the InChIKey of N-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine?
The InChIKey is VAPRZUGDWNWGQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-4-18(15-7-9-17-10-8-15)12-14-11-13(2)5-6-16(14)19-3/h5-6,11,15,17H,4,7-10,12H2,1-3H3.
What are the key properties of N-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine?
N-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine has a molecular weight of 262.40 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-amine is sourced from PubChem (CID 60807135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).