1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine

C16H26N2O2 — CID 79083025

IUPAC1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine
SMILESCCC(NCC1CN(C)CCO1)c1ccccc1OC
InChIInChI=1S/C16H26N2O2/c1-4-15(14-7-5-6-8-16(14)19-3)17-11-13-12-18(2)9-10-20-13/h5-8,13,15,17H,4,9-12H2,1-3H3
InChIKeyMQPDIMDEHNSIPR-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.07
Rot. Bonds6

About 1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine

1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine (PubChem CID 79083025) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine
PubChem CID79083025
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine
SMILESCCC(NCC1CN(C)CCO1)c1ccccc1OC
InChIInChI=1S/C16H26N2O2/c1-4-15(14-7-5-6-8-16(14)19-3)17-11-13-12-18(2)9-10-20-13/h5-8,13,15,17H,4,9-12H2,1-3H3
InChIKeyMQPDIMDEHNSIPR-UHFFFAOYSA-N
XLogP2.07
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine
CID 112634306
(1S)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]-1-phenylpropan-1-amine
CID 95291809
1-(4-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine
CID 78997863
N-(cyclopropylmethyl)-1-(2-methoxyphenyl)propan-1-amine
CID 43693519
(1S)-1-(2-bromophenyl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 81383986
(1R)-1-(2-bromophenyl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 81383657
2-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]aniline
CID 79172087
N-[(4-methylmorpholin-2-yl)methyl]-1-(1,3-thiazol-2-yl)propan-1-amine
CID 79171502
2,6-dimethoxy-N-[(4-methylmorpholin-2-yl)methyl]benzamide
CID 110710223
N-ethyl-1-[2-[(4-methylmorpholin-2-yl)methoxy]phenyl]ethanamine
CID 79171207
N-[(2-ethoxyphenyl)methyl]-1-(4-methylmorpholin-2-yl)methanamine
CID 78943123
3-methyl-N-[(4-methylmorpholin-2-yl)methyl]pentan-2-amine
CID 75356168

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine?
The IUPAC name of 1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine (CID 79083025) is 1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine?
The canonical SMILES for 1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine is CCC(NCC1CN(C)CCO1)c1ccccc1OC.
What is the InChIKey of 1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine?
The InChIKey is MQPDIMDEHNSIPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-4-15(14-7-5-6-8-16(14)19-3)17-11-13-12-18(2)9-10-20-13/h5-8,13,15,17H,4,9-12H2,1-3H3.
What are the key properties of 1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine?
1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine has a molecular weight of 278.40 g/mol, XLogP of 2.07, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine is sourced from PubChem (CID 79083025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).