(2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine

C15H23ClN2O — CID 99824434

IUPAC(2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine
SMILESC[C@@H](CNC[C@@H]1CN(C)CCO1)c1cccc(Cl)c1
InChIInChI=1S/C15H23ClN2O/c1-12(13-4-3-5-14(16)8-13)9-17-10-15-11-18(2)6-7-19-15/h3-5,8,12,15,17H,6-7,9-11H2,1-2H3/t12-,15+/m0/s1
InChIKeyLGJUEYHYTDNLJA-SWLSCSKDSA-N
MW282.81 g/mol
LogP2.36
Rot. Bonds5

About (2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine

(2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine (PubChem CID 99824434) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is (2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine.

Molecular Properties

Compound Name(2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine
PubChem CID99824434
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC Name(2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine
SMILESC[C@@H](CNC[C@@H]1CN(C)CCO1)c1cccc(Cl)c1
InChIInChI=1S/C15H23ClN2O/c1-12(13-4-3-5-14(16)8-13)9-17-10-15-11-18(2)6-7-19-15/h3-5,8,12,15,17H,6-7,9-11H2,1-2H3/t12-,15+/m0/s1
InChIKeyLGJUEYHYTDNLJA-SWLSCSKDSA-N
XLogP2.36
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[2-(3-chlorophenyl)propyl]morpholin-2-yl]methanol
CID 86817957
3-(3-chlorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]cyclobutan-1-amine
CID 79083029
3-(1-aminoethyl)-N-[(4-methylmorpholin-2-yl)methyl]benzenesulfonamide
CID 79083047
3-[1-[(4-methylmorpholin-2-yl)methylamino]ethyl]phenol
CID 79083417
(1S)-1-(3-bromophenyl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 81381423
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide
CID 95336812
3-chloro-N-[2-(4-methylmorpholin-2-yl)ethyl]benzenesulfonamide
CID 110710013
2-methyl-N-[(4-methylmorpholin-2-yl)methyl]butan-1-amine
CID 75356165
2-[(3-chlorophenoxy)methyl]-4-methylmorpholine
CID 71048945
N-[2-(3-chlorophenyl)propyl]-2-methylpropan-1-amine
CID 66436956
(2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine
CID 97045047
1-(3,4-dichlorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 78960515

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine?
The IUPAC name of (2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine (CID 99824434) is (2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine.
What is the SMILES notation for (2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine?
The canonical SMILES for (2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine is C[C@@H](CNC[C@@H]1CN(C)CCO1)c1cccc(Cl)c1.
What is the InChIKey of (2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine?
The InChIKey is LGJUEYHYTDNLJA-SWLSCSKDSA-N. The full InChI is InChI=1S/C15H23ClN2O/c1-12(13-4-3-5-14(16)8-13)9-17-10-15-11-18(2)6-7-19-15/h3-5,8,12,15,17H,6-7,9-11H2,1-2H3/t12-,15+/m0/s1.
What are the key properties of (2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine?
(2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine has a molecular weight of 282.81 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3-chlorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propan-1-amine is sourced from PubChem (CID 99824434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).