N-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide

C16H25N3O2 — CID 43675757

IUPACN-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(CNC(C)CN2CCOCC2)cc1
InChIInChI=1S/C16H25N3O2/c1-13(12-19-7-9-21-10-8-19)17-11-15-3-5-16(6-4-15)18-14(2)20/h3-6,13,17H,7-12H2,1-2H3,(H,18,20)
InChIKeyOCOCJMKLMSGHPF-UHFFFAOYSA-N
MW291.40 g/mol
LogP1.46
Rot. Bonds6

About N-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide

N-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide (PubChem CID 43675757) has the molecular formula C16H25N3O2 and a molecular weight of 291.40 g/mol. Its IUPAC name is N-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide
PubChem CID43675757
Molecular FormulaC16H25N3O2
Molecular Weight291.40 g/mol
Exact Mass291.19
IUPAC NameN-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(CNC(C)CN2CCOCC2)cc1
InChIInChI=1S/C16H25N3O2/c1-13(12-19-7-9-21-10-8-19)17-11-15-3-5-16(6-4-15)18-14(2)20/h3-6,13,17H,7-12H2,1-2H3,(H,18,20)
InChIKeyOCOCJMKLMSGHPF-UHFFFAOYSA-N
XLogP1.46
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(1-morpholin-4-ylpropan-2-ylamino)methyl]furan-2-carboxylic acid
CID 63317091
N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-morpholin-4-ylpropan-2-amine
CID 43675675
N-[2-(1-morpholin-4-ylpropan-2-ylamino)ethyl]acetamide
CID 107529281
2-(benzylamino)-3-morpholin-4-ylpropanoic acid
CID 91254110
1-morpholin-4-yl-N-[(3,4,5-trifluorophenyl)methyl]propan-2-amine
CID 63051875
N-[(5-ethylfuran-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 62345255
2-methyl-3-(methylamino)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide
CID 79203852
N-[4-[(heptan-2-ylamino)methyl]phenyl]acetamide
CID 43399864
N-[4-[(4-methylsulfanylbutan-2-ylamino)methyl]phenyl]acetamide
CID 115639969
N-[4-[[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methylamino]methyl]phenyl]acetamide
CID 9268036
2-(4-acetamidophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 26599953
1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine
CID 62699740

Frequently Asked Questions

What is the IUPAC name of N-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide?
The IUPAC name of N-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide (CID 43675757) is N-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide is CC(=O)Nc1ccc(CNC(C)CN2CCOCC2)cc1.
What is the InChIKey of N-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide?
The InChIKey is OCOCJMKLMSGHPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-13(12-19-7-9-21-10-8-19)17-11-15-3-5-16(6-4-15)18-14(2)20/h3-6,13,17H,7-12H2,1-2H3,(H,18,20).
What are the key properties of N-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide?
N-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide has a molecular weight of 291.40 g/mol, XLogP of 1.46, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(1-morpholin-4-ylpropan-2-ylamino)methyl]phenyl]acetamide is sourced from PubChem (CID 43675757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).