2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide

C16H23N5O2 — CID 125141381

IUPAC2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide
SMILESCN(CC(N)=O)C[C@@H]1CN(c2nc3ccccc3n2C)CCO1
InChIInChI=1S/C16H23N5O2/c1-19(11-15(17)22)9-12-10-21(7-8-23-12)16-18-13-5-3-4-6-14(13)20(16)2/h3-6,12H,7-11H2,1-2H3,(H2,17,22)/t12-/m1/s1
InChIKeyLFBYSFSDFOKPJR-GFCCVEGCSA-N
MW317.39 g/mol
LogP0.20
Rot. Bonds5

About 2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide

2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide (PubChem CID 125141381) has the molecular formula C16H23N5O2 and a molecular weight of 317.39 g/mol. Its IUPAC name is 2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide.

Molecular Properties

Compound Name2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide
PubChem CID125141381
Molecular FormulaC16H23N5O2
Molecular Weight317.39 g/mol
Exact Mass317.19
IUPAC Name2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide
SMILESCN(CC(N)=O)C[C@@H]1CN(c2nc3ccccc3n2C)CCO1
InChIInChI=1S/C16H23N5O2/c1-19(11-15(17)22)9-12-10-21(7-8-23-12)16-18-13-5-3-4-6-14(13)20(16)2/h3-6,12H,7-11H2,1-2H3,(H2,17,22)/t12-/m1/s1
InChIKeyLFBYSFSDFOKPJR-GFCCVEGCSA-N
XLogP0.20
TPSA76.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[[4-(2-cyclopropylpyrimidin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide
CID 128969399
2-[[4-(3-ethyl-1,2,4-thiadiazol-5-yl)morpholin-2-yl]methyl-methylamino]acetamide
CID 128969383
2-[methyl-[[(2R)-4-(1,6-naphthyridin-4-yl)morpholin-2-yl]methyl]amino]acetamide
CID 124875126
2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide
CID 125141474
2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide
CID 125141326
2-[[4-(4-cyano-3-methylpyrido[1,2-a]benzimidazol-1-yl)morpholin-2-yl]methyl-methylamino]acetic acid
CID 120965245
2-[[(2S)-4-(6-amino-5-chloropyrimidin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide
CID 125141490
2-[methyl-[[(2R)-4-[5-(trifluoromethyl)-1,3-thiazol-2-yl]morpholin-2-yl]methyl]amino]acetamide
CID 124875294
6-[2-[[(2-amino-2-oxoethyl)-methylamino]methyl]morpholin-4-yl]-5-chloro-N,N-dimethylpyridine-3-carboxamide
CID 126810031
2-[[(2R)-4-[2-(2-ethylbenzimidazol-1-yl)acetyl]morpholin-2-yl]methyl-methylamino]acetic acid
CID 129475210
2-[(4-ethylsulfonylmorpholin-2-yl)methyl-methylamino]acetamide
CID 154739726
2-[[(2-amino-2-oxoethyl)-methylamino]methyl]-N-(2-methyl-4-pyridinyl)morpholine-4-carboxamide
CID 167933180

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide?
The IUPAC name of 2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide (CID 125141381) is 2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide.
What is the SMILES notation for 2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide?
The canonical SMILES for 2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide is CN(CC(N)=O)C[C@@H]1CN(c2nc3ccccc3n2C)CCO1.
What is the InChIKey of 2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide?
The InChIKey is LFBYSFSDFOKPJR-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H23N5O2/c1-19(11-15(17)22)9-12-10-21(7-8-23-12)16-18-13-5-3-4-6-14(13)20(16)2/h3-6,12H,7-11H2,1-2H3,(H2,17,22)/t12-/m1/s1.
What are the key properties of 2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide?
2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide has a molecular weight of 317.39 g/mol, XLogP of 0.20, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide is sourced from PubChem (CID 125141381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).