N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine

C16H26N2O2 — CID 83100679

IUPACN-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine
SMILESCOc1ccccc1CN1CCOCC1CNC(C)C
InChIInChI=1S/C16H26N2O2/c1-13(2)17-10-15-12-20-9-8-18(15)11-14-6-4-5-7-16(14)19-3/h4-7,13,15,17H,8-12H2,1-3H3
InChIKeyHISWKAQWXJPFHD-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.89
Rot. Bonds6

About N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine

N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine (PubChem CID 83100679) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine
PubChem CID83100679
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine
SMILESCOc1ccccc1CN1CCOCC1CNC(C)C
InChIInChI=1S/C16H26N2O2/c1-13(2)17-10-15-12-20-9-8-18(15)11-14-6-4-5-7-16(14)19-3/h4-7,13,15,17H,8-12H2,1-3H3
InChIKeyHISWKAQWXJPFHD-UHFFFAOYSA-N
XLogP1.89
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 ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[4-[(2-bromo-3-fluorophenyl)methyl]morpholin-3-yl]methyl]propan-2-amine
CID 83100350
1-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-3-yl]-N-methylmethanamine
CID 104792418
N-[[4-[(2,5-dichlorophenyl)methyl]morpholin-3-yl]methyl]propan-2-amine
CID 83100433
N-[[4-[(6-methyl-2-pyridinyl)methyl]morpholin-3-yl]methyl]propan-2-amine
CID 83100188
N-[[1-[(2-methoxy-5-methylphenyl)methyl]piperidin-2-yl]methyl]propan-2-amine
CID 62579495
N-[[4-[(5-bromo-2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-1-amine
CID 83101094
1-[3-[(3-ethylmorpholin-4-yl)methyl]-4-methoxyphenyl]ethanamine
CID 60860565
N-[[4-[(2,5-dimethylpyrazol-3-yl)methyl]morpholin-3-yl]methyl]propan-2-amine
CID 83100020
N-[[4-(5-methoxy-2-pyridinyl)morpholin-3-yl]methyl]propan-2-amine
CID 106504984
N-[(2-methoxyphenyl)methyl]propan-2-amine
CID 11458027
N-[[4-[(2-methoxy-3-pyridinyl)methyl]morpholin-3-yl]methyl]cyclopropanamine
CID 83100593
N-[[4-[(1-ethylpyrazol-4-yl)methyl]morpholin-3-yl]methyl]propan-2-amine
CID 83099773

Frequently Asked Questions

What is the IUPAC name of N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine?
The IUPAC name of N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine (CID 83100679) is N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine is COc1ccccc1CN1CCOCC1CNC(C)C.
What is the InChIKey of N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine?
The InChIKey is HISWKAQWXJPFHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-13(2)17-10-15-12-20-9-8-18(15)11-14-6-4-5-7-16(14)19-3/h4-7,13,15,17H,8-12H2,1-3H3.
What are the key properties of N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine?
N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine has a molecular weight of 278.40 g/mol, XLogP of 1.89, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(2-methoxyphenyl)methyl]morpholin-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 83100679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).