2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide

C10H19N3O3 — CID 103898599

IUPAC2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide
SMILESCNC(=O)NC(=O)CN1CCC(C)C(O)C1
InChIInChI=1S/C10H19N3O3/c1-7-3-4-13(5-8(7)14)6-9(15)12-10(16)11-2/h7-8,14H,3-6H2,1-2H3,(H2,11,12,15,16)
InChIKeyWHRQNUPMPDNANA-UHFFFAOYSA-N
MW229.28 g/mol
LogP-0.86
Rot. Bonds2

About 2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide

2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide (PubChem CID 103898599) has the molecular formula C10H19N3O3 and a molecular weight of 229.28 g/mol. Its IUPAC name is 2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide
PubChem CID103898599
Molecular FormulaC10H19N3O3
Molecular Weight229.28 g/mol
Exact Mass229.14
IUPAC Name2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide
SMILESCNC(=O)NC(=O)CN1CCC(C)C(O)C1
InChIInChI=1S/C10H19N3O3/c1-7-3-4-13(5-8(7)14)6-9(15)12-10(16)11-2/h7-8,14H,3-6H2,1-2H3,(H2,11,12,15,16)
InChIKeyWHRQNUPMPDNANA-UHFFFAOYSA-N
XLogP-0.86
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 5-0.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(ethylcarbamoyl)-2-(3-hydroxy-4-methylpiperidin-1-yl)acetamide
CID 103898104
N-(cyclopropylcarbamoyl)-2-(3-hydroxy-4-methylpiperidin-1-yl)acetamide
CID 103898008
2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide
CID 119923266
2-(4-amino-3-ethylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide
CID 81460476
2-[3-(1-aminoethyl)pyrrolidin-1-yl]-N-(methylcarbamoyl)acetamide
CID 112630035
2-(3-aminopiperidin-1-yl)-N-(methylcarbamoyl)acetamide
CID 61296110
2-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-N-(methylcarbamoyl)acetamide
CID 80553182
2-[(3R)-3-(4-methoxyphenyl)pyrrolidin-1-yl]-N-(methylcarbamoyl)acetamide
CID 94797807
2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-(methylcarbamoyl)acetamide
CID 8520083
2-[4-(methylaminomethyl)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride
CID 119922349
N-heptan-2-yl-2-(3-hydroxy-4-methylpiperidin-1-yl)acetamide
CID 103898417
2-[(3-hydroxy-4-methylpiperidin-1-yl)methyl]prop-2-enoic acid
CID 102959425

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide?
The IUPAC name of 2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide (CID 103898599) is 2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide.
What is the SMILES notation for 2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide?
The canonical SMILES for 2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide is CNC(=O)NC(=O)CN1CCC(C)C(O)C1.
What is the InChIKey of 2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide?
The InChIKey is WHRQNUPMPDNANA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O3/c1-7-3-4-13(5-8(7)14)6-9(15)12-10(16)11-2/h7-8,14H,3-6H2,1-2H3,(H2,11,12,15,16).
What are the key properties of 2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide?
2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide has a molecular weight of 229.28 g/mol, XLogP of -0.86, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxy-4-methylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide is sourced from PubChem (CID 103898599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).