2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide

C12H23N3O2 — CID 8543273

IUPAC2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide
SMILESCC1CCN(CC(=O)NC(=O)NC(C)C)CC1
InChIInChI=1S/C12H23N3O2/c1-9(2)13-12(17)14-11(16)8-15-6-4-10(3)5-7-15/h9-10H,4-8H2,1-3H3,(H2,13,14,16,17)
InChIKeyMMLZRFAMDYAMOE-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.95
Rot. Bonds3

About 2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide

2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide (PubChem CID 8543273) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide
PubChem CID8543273
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide
SMILESCC1CCN(CC(=O)NC(=O)NC(C)C)CC1
InChIInChI=1S/C12H23N3O2/c1-9(2)13-12(17)14-11(16)8-15-6-4-10(3)5-7-15/h9-10H,4-8H2,1-3H3,(H2,13,14,16,17)
InChIKeyMMLZRFAMDYAMOE-UHFFFAOYSA-N
XLogP0.95
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl]piperidin-4-yl]acetic acid
CID 79608129
2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(propan-2-ylcarbamoyl)acetamide
CID 80552476
N-(cyclohexylcarbamoyl)-2-(4-methylpiperidin-1-yl)acetamide
CID 2655086
2-[3-(methylaminomethyl)pyrrolidin-1-yl]-N-(propan-2-ylcarbamoyl)acetamide
CID 63267514
2-[2-(aminomethyl)-4-methylpiperidin-1-yl]-N-(propan-2-ylcarbamoyl)acetamide
CID 103442104
2-[1-[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl]piperidin-3-yl]acetic acid
CID 62689759
2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-N-(propan-2-ylcarbamoyl)acetamide
CID 30968389
N-(propan-2-ylcarbamoyl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-yl]acetamide
CID 27098406
N-iodo-2-(4-methylpiperidin-1-yl)acetamide
CID 171081144
(2S)-3-methyl-2-[[2-(4-methylpiperidin-1-yl)acetyl]amino]butanoic acid
CID 92919551
2-(4-hydroxypiperidin-1-yl)-N-propan-2-ylacetamide
CID 20770430
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-(propan-2-ylcarbamoyl)acetamide
CID 81492867

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide?
The IUPAC name of 2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide (CID 8543273) is 2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide.
What is the SMILES notation for 2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide?
The canonical SMILES for 2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide is CC1CCN(CC(=O)NC(=O)NC(C)C)CC1.
What is the InChIKey of 2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide?
The InChIKey is MMLZRFAMDYAMOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-9(2)13-12(17)14-11(16)8-15-6-4-10(3)5-7-15/h9-10H,4-8H2,1-3H3,(H2,13,14,16,17).
What are the key properties of 2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide?
2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide has a molecular weight of 241.33 g/mol, XLogP of 0.95, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide is sourced from PubChem (CID 8543273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).