3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide

C22H29N3O2 — CID 17489984

IUPAC3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide
SMILESCCC(C)C(C(=O)NCc1ccc(N2CCOCC2)nc1)c1ccccc1
InChIInChI=1S/C22H29N3O2/c1-3-17(2)21(19-7-5-4-6-8-19)22(26)24-16-18-9-10-20(23-15-18)25-11-13-27-14-12-25/h4-10,15,17,21H,3,11-14,16H2,1-2H3,(H,24,26)
InChIKeyIHZUETMICLFNNA-UHFFFAOYSA-N
MW367.49 g/mol
LogP3.36
Rot. Bonds7

About 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide

3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide (PubChem CID 17489984) has the molecular formula C22H29N3O2 and a molecular weight of 367.49 g/mol. Its IUPAC name is 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide.

Molecular Properties

Compound Name3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide
PubChem CID17489984
Molecular FormulaC22H29N3O2
Molecular Weight367.49 g/mol
Exact Mass367.23
IUPAC Name3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide
SMILESCCC(C)C(C(=O)NCc1ccc(N2CCOCC2)nc1)c1ccccc1
InChIInChI=1S/C22H29N3O2/c1-3-17(2)21(19-7-5-4-6-8-19)22(26)24-16-18-9-10-20(23-15-18)25-11-13-27-14-12-25/h4-10,15,17,21H,3,11-14,16H2,1-2H3,(H,24,26)
InChIKeyIHZUETMICLFNNA-UHFFFAOYSA-N
XLogP3.36
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.49
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenoxypropanamide
CID 18145200
2-methoxy-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
CID 47303387
2-methyl-3-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-3-oxopropanoic acid
CID 114897147
3-chloro-2-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
CID 62727165
1-(2-ethyl-1-phenylbutyl)-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea
CID 42962719
2-benzylsulfanyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
CID 47046949
2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
CID 46581557
(2S)-2-amino-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylpropanamide;dihydrochloride
CID 119839457
3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-[(2-phenoxyacetyl)amino]butanamide
CID 42934862
(2R)-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
CID 98753721
2-methyl-N-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]butanamide
CID 46598711
1-methyl-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]-1-[(S)-phenyl(pyridin-2-yl)methyl]urea
CID 51957434

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide?
The IUPAC name of 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide (CID 17489984) is 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide.
What is the SMILES notation for 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide?
The canonical SMILES for 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide is CCC(C)C(C(=O)NCc1ccc(N2CCOCC2)nc1)c1ccccc1.
What is the InChIKey of 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide?
The InChIKey is IHZUETMICLFNNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O2/c1-3-17(2)21(19-7-5-4-6-8-19)22(26)24-16-18-9-10-20(23-15-18)25-11-13-27-14-12-25/h4-10,15,17,21H,3,11-14,16H2,1-2H3,(H,24,26).
What are the key properties of 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide?
3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide has a molecular weight of 367.49 g/mol, XLogP of 3.36, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenylpentanamide is sourced from PubChem (CID 17489984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).