2-[(4-methylmorpholin-2-yl)methylamino]propanamide

C9H19N3O2 — CID 78945177

IUPAC2-[(4-methylmorpholin-2-yl)methylamino]propanamide
SMILESCC(NCC1CN(C)CCO1)C(N)=O
InChIInChI=1S/C9H19N3O2/c1-7(9(10)13)11-5-8-6-12(2)3-4-14-8/h7-8,11H,3-6H2,1-2H3,(H2,10,13)
InChIKeyTZSRAYMLRGBUSN-UHFFFAOYSA-N
MW201.27 g/mol
LogP-1.22
Rot. Bonds4

About 2-[(4-methylmorpholin-2-yl)methylamino]propanamide

2-[(4-methylmorpholin-2-yl)methylamino]propanamide (PubChem CID 78945177) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-[(4-methylmorpholin-2-yl)methylamino]propanamide.

Molecular Properties

Compound Name2-[(4-methylmorpholin-2-yl)methylamino]propanamide
PubChem CID78945177
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC Name2-[(4-methylmorpholin-2-yl)methylamino]propanamide
SMILESCC(NCC1CN(C)CCO1)C(N)=O
InChIInChI=1S/C9H19N3O2/c1-7(9(10)13)11-5-8-6-12(2)3-4-14-8/h7-8,11H,3-6H2,1-2H3,(H2,10,13)
InChIKeyTZSRAYMLRGBUSN-UHFFFAOYSA-N
XLogP-1.22
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-1.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-methylmorpholin-2-yl)methylamino]propanoic acid
CID 78967405
N-methyl-2-[(4-methylmorpholin-2-yl)methylamino]propanamide
CID 78945377
(2R)-1-(azepan-1-yl)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]propan-1-one
CID 95302737
N-[[(2S)-4-methylmorpholin-2-yl]methyl]propan-2-amine
CID 96645037
N-methyl-3-[(4-methylmorpholin-2-yl)methylamino]butanamide
CID 115889192
(2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide
CID 95293289
2-[(4-methylmorpholin-2-yl)methylamino]propan-1-ol
CID 78945058
2-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide
CID 153398973
(2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine
CID 97045041
(1S)-1-cyclopropyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]ethanamine
CID 97045036
4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pentan-2-amine
CID 75356159
2-amino-3-(4-methylmorpholin-2-yl)propanamide
CID 79172417

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methylmorpholin-2-yl)methylamino]propanamide?
The IUPAC name of 2-[(4-methylmorpholin-2-yl)methylamino]propanamide (CID 78945177) is 2-[(4-methylmorpholin-2-yl)methylamino]propanamide.
What is the SMILES notation for 2-[(4-methylmorpholin-2-yl)methylamino]propanamide?
The canonical SMILES for 2-[(4-methylmorpholin-2-yl)methylamino]propanamide is CC(NCC1CN(C)CCO1)C(N)=O.
What is the InChIKey of 2-[(4-methylmorpholin-2-yl)methylamino]propanamide?
The InChIKey is TZSRAYMLRGBUSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-7(9(10)13)11-5-8-6-12(2)3-4-14-8/h7-8,11H,3-6H2,1-2H3,(H2,10,13).
What are the key properties of 2-[(4-methylmorpholin-2-yl)methylamino]propanamide?
2-[(4-methylmorpholin-2-yl)methylamino]propanamide has a molecular weight of 201.27 g/mol, XLogP of -1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methylmorpholin-2-yl)methylamino]propanamide is sourced from PubChem (CID 78945177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).