N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine

C15H23ClN2O — CID 58948569

IUPACN-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine
SMILESCC(C)NCC(c1cccc(Cl)c1)N1CCOCC1
InChIInChI=1S/C15H23ClN2O/c1-12(2)17-11-15(18-6-8-19-9-7-18)13-4-3-5-14(16)10-13/h3-5,10,12,15,17H,6-9,11H2,1-2H3
InChIKeyALPZECQXSMHEKB-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.71
Rot. Bonds5

About N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine

N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine (PubChem CID 58948569) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine
PubChem CID58948569
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC NameN-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine
SMILESCC(C)NCC(c1cccc(Cl)c1)N1CCOCC1
InChIInChI=1S/C15H23ClN2O/c1-12(2)17-11-15(18-6-8-19-9-7-18)13-4-3-5-14(16)10-13/h3-5,10,12,15,17H,6-9,11H2,1-2H3
InChIKeyALPZECQXSMHEKB-UHFFFAOYSA-N
XLogP2.71
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 ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(3-chlorophenyl)-N-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]-2-morpholin-4-ylethanamine
CID 97066602
N-[(2S)-2-(3-chlorophenyl)-2-morpholin-4-ylethyl]pyrimidin-2-amine
CID 95312339
1-[(2R)-2-(3-chlorophenyl)-2-morpholin-4-ylethyl]-3-prop-2-ynylurea
CID 95315480
(2S,3R)-N-[(2S)-2-(3-chlorophenyl)-2-morpholin-4-ylethyl]-2-methyloxolan-3-amine
CID 100906281
1-[(2S)-2-(3-chlorophenyl)-2-morpholin-4-ylethyl]-2,3-dimethylguanidine
CID 99845927
1-butan-2-yl-3-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]-2-methylguanidine;hydroiodide
CID 110945519
1-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]-2-methyl-3-(3-methylbutyl)guanidine
CID 110978911
N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]-1,4,5,6-tetrahydropyrimidin-2-amine
CID 110934883
1-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]-2-methyl-3-(2-piperidin-1-ylethyl)guanidine
CID 111415281
N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 51108370
1-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]-3-(3-hydroxy-2-phenylpropyl)-2-methylguanidine
CID 109410103
4-[[[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]amino]methyl]benzonitrile
CID 119123498

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine?
The IUPAC name of N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine (CID 58948569) is N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine.
What is the SMILES notation for N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine?
The canonical SMILES for N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine is CC(C)NCC(c1cccc(Cl)c1)N1CCOCC1.
What is the InChIKey of N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine?
The InChIKey is ALPZECQXSMHEKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClN2O/c1-12(2)17-11-15(18-6-8-19-9-7-18)13-4-3-5-14(16)10-13/h3-5,10,12,15,17H,6-9,11H2,1-2H3.
What are the key properties of N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine?
N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine has a molecular weight of 282.81 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine is sourced from PubChem (CID 58948569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).