N-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide

C22H29N3O3 — CID 17491426

IUPACN-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide
SMILESCOc1ccc(NC(=O)C(C)N(C)Cc2ccccc2N2CCOCC2)cc1
InChIInChI=1S/C22H29N3O3/c1-17(22(26)23-19-8-10-20(27-3)11-9-19)24(2)16-18-6-4-5-7-21(18)25-12-14-28-15-13-25/h4-11,17H,12-16H2,1-3H3,(H,23,26)
InChIKeyCFJPEZZWVHWDBB-UHFFFAOYSA-N
MW383.49 g/mol
LogP2.99
Rot. Bonds7

About N-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide

N-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide (PubChem CID 17491426) has the molecular formula C22H29N3O3 and a molecular weight of 383.49 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide
PubChem CID17491426
Molecular FormulaC22H29N3O3
Molecular Weight383.49 g/mol
Exact Mass383.22
IUPAC NameN-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide
SMILESCOc1ccc(NC(=O)C(C)N(C)Cc2ccccc2N2CCOCC2)cc1
InChIInChI=1S/C22H29N3O3/c1-17(22(26)23-19-8-10-20(27-3)11-9-19)24(2)16-18-6-4-5-7-21(18)25-12-14-28-15-13-25/h4-11,17H,12-16H2,1-3H3,(H,23,26)
InChIKeyCFJPEZZWVHWDBB-UHFFFAOYSA-N
XLogP2.99
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.49
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]-N-phenylpropanamide
CID 26381814
(2R)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]-N-(4-piperidin-1-ylphenyl)propanamide
CID 41118821
N-(3-chloro-4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide
CID 17491927
N-(3-fluorophenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide
CID 42888083
(2R)-N-(3-chlorophenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide
CID 26381467
2-[methyl-[(2-pyrrolidin-1-ylphenyl)methyl]amino]-N-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 45356007
2-[methyl-[(2-methylphenyl)methyl]amino]-N-(4-morpholin-4-ylphenyl)propanamide
CID 51168347
(2S)-N-(2,4-dimethylphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide
CID 25468215
(2R)-N-(4-chloro-2-fluorophenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide
CID 26382172
(2R)-N-(2-chloro-4-fluorophenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide
CID 25329070
(2R)-2-[methyl-[(2-piperidin-1-ylphenyl)methyl]amino]-N-(4-nitrophenyl)propanamide
CID 40795616
methyl (2S)-2-(2-chlorophenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]acetate
CID 51932562

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide?
The IUPAC name of N-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide (CID 17491426) is N-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide is COc1ccc(NC(=O)C(C)N(C)Cc2ccccc2N2CCOCC2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide?
The InChIKey is CFJPEZZWVHWDBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O3/c1-17(22(26)23-19-8-10-20(27-3)11-9-19)24(2)16-18-6-4-5-7-21(18)25-12-14-28-15-13-25/h4-11,17H,12-16H2,1-3H3,(H,23,26).
What are the key properties of N-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide?
N-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide has a molecular weight of 383.49 g/mol, XLogP of 2.99, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]propanamide is sourced from PubChem (CID 17491426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).