2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine

C17H28N2O — CID 43202117

IUPAC2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine
SMILESCCC(NCC(C)(C)N1CCOCC1)c1ccccc1
InChIInChI=1S/C17H28N2O/c1-4-16(15-8-6-5-7-9-15)18-14-17(2,3)19-10-12-20-13-11-19/h5-9,16,18H,4,10-14H2,1-3H3
InChIKeyZJOCNAYFOLRHQP-UHFFFAOYSA-N
MW276.42 g/mol
LogP2.84
Rot. Bonds6

About 2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine

2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine (PubChem CID 43202117) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine
PubChem CID43202117
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine
SMILESCCC(NCC(C)(C)N1CCOCC1)c1ccccc1
InChIInChI=1S/C17H28N2O/c1-4-16(15-8-6-5-7-9-15)18-14-17(2,3)19-10-12-20-13-11-19/h5-9,16,18H,4,10-14H2,1-3H3
InChIKeyZJOCNAYFOLRHQP-UHFFFAOYSA-N
XLogP2.84
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-1-phenylethanol
CID 2115118
2-phenyl-1-(1-phenylpropylamino)propan-2-ol
CID 62374681
N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide
CID 47005479
2-methyl-1-[[(1R)-1-phenylpropyl]amino]propan-2-ol
CID 94396195
N-(2-methyl-2-morpholin-4-ylpropyl)-3-phenylbutanamide
CID 4801976
N-(2-methyl-2-morpholin-4-ylpropyl)hexan-3-amine
CID 103920861
(3R)-3-[(2-methyl-2-morpholin-4-ylpropanoyl)amino]-3-phenylpropanoic acid
CID 126434254
2-methyl-2-morpholin-4-yl-N-(1-thiophen-3-ylethyl)propan-1-amine
CID 62091009
2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]-2-morpholin-4-ylpropan-1-amine
CID 106756920
N-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide
CID 4796277
N,2-dimethyl-2-morpholin-4-yl-1-phenylpropan-1-amine
CID 79050725
3-hydroxy-N-(2-methyl-2-morpholin-4-ylpropyl)-3-phenylbutanamide
CID 110024325

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine?
The IUPAC name of 2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine (CID 43202117) is 2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine.
What is the SMILES notation for 2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine?
The canonical SMILES for 2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine is CCC(NCC(C)(C)N1CCOCC1)c1ccccc1.
What is the InChIKey of 2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine?
The InChIKey is ZJOCNAYFOLRHQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-4-16(15-8-6-5-7-9-15)18-14-17(2,3)19-10-12-20-13-11-19/h5-9,16,18H,4,10-14H2,1-3H3.
What are the key properties of 2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine?
2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine has a molecular weight of 276.42 g/mol, XLogP of 2.84, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine is sourced from PubChem (CID 43202117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).