N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine

C16H26N2O — CID 115118462

IUPACN-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine
SMILESCOc1c(C)cc(C)cc1CCNC1CCNCC1
InChIInChI=1S/C16H26N2O/c1-12-10-13(2)16(19-3)14(11-12)4-9-18-15-5-7-17-8-6-15/h10-11,15,17-18H,4-9H2,1-3H3
InChIKeyGFFMMNDSRCYATG-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.20
Rot. Bonds5

About N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine

N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine (PubChem CID 115118462) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine.

Molecular Properties

Compound NameN-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine
PubChem CID115118462
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine
SMILESCOc1c(C)cc(C)cc1CCNC1CCNCC1
InChIInChI=1S/C16H26N2O/c1-12-10-13(2)16(19-3)14(11-12)4-9-18-15-5-7-17-8-6-15/h10-11,15,17-18H,4-9H2,1-3H3
InChIKeyGFFMMNDSRCYATG-UHFFFAOYSA-N
XLogP2.20
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]cyclopropanamine
CID 96661815
N'-cyclopropyl-N-[(2-methoxy-3,5-dimethylphenyl)methyl]ethane-1,2-diamine
CID 115206963
N-[2-(4-methoxy-2,3-dimethylphenyl)ethyl]piperidin-4-amine
CID 115118464
N-[2-(2-methoxy-4,5-dimethylphenyl)ethyl]pyrrolidin-3-amine
CID 115118996
N-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]pyrrolidin-3-amine
CID 115119043
N'-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]ethane-1,2-diamine
CID 115195427
N-(2-chloroethyl)-2-(2-methoxy-3,5-dimethylphenyl)ethanamine
CID 115215064
N-[2-[2-(3,5-dimethoxyphenyl)phenyl]ethyl]piperidin-4-amine
CID 67167956
N-[2-(4-methylphenyl)ethyl]piperidin-4-amine
CID 22643507
N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine
CID 82494846
N'-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]-N-methylbutane-1,4-diamine
CID 115202127
N-ethyl-3-(2-methoxy-3,5-dimethylphenyl)propan-1-amine
CID 98014326

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine?
The IUPAC name of N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine (CID 115118462) is N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine.
What is the SMILES notation for N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine?
The canonical SMILES for N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine is COc1c(C)cc(C)cc1CCNC1CCNCC1.
What is the InChIKey of N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine?
The InChIKey is GFFMMNDSRCYATG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-12-10-13(2)16(19-3)14(11-12)4-9-18-15-5-7-17-8-6-15/h10-11,15,17-18H,4-9H2,1-3H3.
What are the key properties of N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine?
N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine has a molecular weight of 262.40 g/mol, XLogP of 2.20, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine is sourced from PubChem (CID 115118462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).