2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide

C12H23N3O2 — CID 8903288

IUPAC2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide
SMILESCCCNC(=O)NC(=O)CN1CCC[C@@H](C)C1
InChIInChI=1S/C12H23N3O2/c1-3-6-13-12(17)14-11(16)9-15-7-4-5-10(2)8-15/h10H,3-9H2,1-2H3,(H2,13,14,16,17)/t10-/m1/s1
InChIKeyPUKZCEACHCFSRG-SNVBAGLBSA-N
MW241.33 g/mol
LogP0.95
Rot. Bonds4

About 2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide

2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide (PubChem CID 8903288) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide
PubChem CID8903288
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide
SMILESCCCNC(=O)NC(=O)CN1CCC[C@@H](C)C1
InChIInChI=1S/C12H23N3O2/c1-3-6-13-12(17)14-11(16)9-15-7-4-5-10(2)8-15/h10H,3-9H2,1-2H3,(H2,13,14,16,17)/t10-/m1/s1
InChIKeyPUKZCEACHCFSRG-SNVBAGLBSA-N
XLogP0.95
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
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

N-(2-methoxyethylcarbamoyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 51170639
2-(3,5-dimethylpiperidin-1-yl)-N-(propylcarbamoyl)acetamide
CID 51170715
2-(3-methylpiperidin-1-yl)-N-(2-methylpropylcarbamoyl)acetamide
CID 51170637
2-(3-methylpiperidin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide
CID 51170634
N-[2-(cyclohexen-1-yl)ethylcarbamoyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide
CID 8903400
2-(3-methylpiperidin-1-yl)acetohydrazide
CID 43906557
2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]-N-(propylcarbamoyl)acetamide
CID 112628199
2-[3-(aminomethyl)pyrrolidin-1-yl]-N-(propylcarbamoyl)acetamide
CID 62064117
N-[(3,4-dimethylphenyl)carbamoyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide
CID 9275400
2-[(3R)-3-methylpiperidin-1-yl]-N-(thiophen-2-ylmethylcarbamoyl)acetamide
CID 9275407
2-(3-amino-4-methylpyrrolidin-1-yl)-N-(propylcarbamoyl)acetamide
CID 103576948
2-(1,4-diazepan-1-yl)-N-(propylcarbamoyl)acetamide;hydrochloride
CID 119906348

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide?
The IUPAC name of 2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide (CID 8903288) is 2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide.
What is the SMILES notation for 2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide?
The canonical SMILES for 2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide is CCCNC(=O)NC(=O)CN1CCC[C@@H](C)C1.
What is the InChIKey of 2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide?
The InChIKey is PUKZCEACHCFSRG-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-3-6-13-12(17)14-11(16)9-15-7-4-5-10(2)8-15/h10H,3-9H2,1-2H3,(H2,13,14,16,17)/t10-/m1/s1.
What are the key properties of 2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide?
2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide has a molecular weight of 241.33 g/mol, XLogP of 0.95, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-3-methylpiperidin-1-yl]-N-(propylcarbamoyl)acetamide is sourced from PubChem (CID 8903288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).