(2-ethyl-4-methoxyphenyl)methanamine;hydrochloride

C10H16ClNO — CID 146082087

IUPAC(2-ethyl-4-methoxyphenyl)methanamine;hydrochloride
SMILESCCc1cc(OC)ccc1CN.Cl
InChIInChI=1S/C10H15NO.ClH/c1-3-8-6-10(12-2)5-4-9(8)7-11;/h4-6H,3,7,11H2,1-2H3;1H
InChIKeySVWZEGRBXCWWAE-UHFFFAOYSA-N
MW201.70 g/mol
LogP2.14
Rot. Bonds3

About (2-ethyl-4-methoxyphenyl)methanamine;hydrochloride

(2-ethyl-4-methoxyphenyl)methanamine;hydrochloride (PubChem CID 146082087) has the molecular formula C10H16ClNO and a molecular weight of 201.70 g/mol. Its IUPAC name is (2-ethyl-4-methoxyphenyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(2-ethyl-4-methoxyphenyl)methanamine;hydrochloride
PubChem CID146082087
Molecular FormulaC10H16ClNO
Molecular Weight201.70 g/mol
Exact Mass201.09
IUPAC Name(2-ethyl-4-methoxyphenyl)methanamine;hydrochloride
SMILESCCc1cc(OC)ccc1CN.Cl
InChIInChI=1S/C10H15NO.ClH/c1-3-8-6-10(12-2)5-4-9(8)7-11;/h4-6H,3,7,11H2,1-2H3;1H
InChIKeySVWZEGRBXCWWAE-UHFFFAOYSA-N
XLogP2.14
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.70
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 170917022
(1-ethyl-7-methoxynaphthalen-2-yl)methanamine
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CID 155696635
CID 155696635
1-ethyl-4-methoxy-2-(methoxymethyl)benzene
CID 143738113
(2-chloro-4-methoxyphenyl)methanamine
CID 22467642
2-bromo-1-ethyl-4-methoxybenzene
CID 59138196
2-(aminomethyl)-5-methoxyphenol;ethane
CID 154662698
ethane;1-ethyl-4-methoxy-2-methylbenzene
CID 142129466
2-(aminomethyl)-4-methoxybenzonitrile
CID 22464511
(2-ethynyl-5-methoxyphenyl)methanamine
CID 130535133
5-(2-ethyl-4-methoxyphenyl)-4-methylpentan-2-amine
CID 83941578
1-but-3-enyl-2-ethyl-4-methoxybenzene
CID 83941580

Frequently Asked Questions

What is the IUPAC name of (2-ethyl-4-methoxyphenyl)methanamine;hydrochloride?
The IUPAC name of (2-ethyl-4-methoxyphenyl)methanamine;hydrochloride (CID 146082087) is (2-ethyl-4-methoxyphenyl)methanamine;hydrochloride.
What is the SMILES notation for (2-ethyl-4-methoxyphenyl)methanamine;hydrochloride?
The canonical SMILES for (2-ethyl-4-methoxyphenyl)methanamine;hydrochloride is CCc1cc(OC)ccc1CN.Cl.
What is the InChIKey of (2-ethyl-4-methoxyphenyl)methanamine;hydrochloride?
The InChIKey is SVWZEGRBXCWWAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO.ClH/c1-3-8-6-10(12-2)5-4-9(8)7-11;/h4-6H,3,7,11H2,1-2H3;1H.
What are the key properties of (2-ethyl-4-methoxyphenyl)methanamine;hydrochloride?
(2-ethyl-4-methoxyphenyl)methanamine;hydrochloride has a molecular weight of 201.70 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-4-methoxyphenyl)methanamine;hydrochloride is sourced from PubChem (CID 146082087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).