N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide

C12H23N3O2 — CID 46614180

IUPACN-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide
SMILESCCNC(=O)NC(=O)C(C)N1CCC(C)CC1
InChIInChI=1S/C12H23N3O2/c1-4-13-12(17)14-11(16)10(3)15-7-5-9(2)6-8-15/h9-10H,4-8H2,1-3H3,(H2,13,14,16,17)
InChIKeyHCSRINMUJLVJGR-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.95
Rot. Bonds3

About N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide

N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide (PubChem CID 46614180) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide
PubChem CID46614180
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide
SMILESCCNC(=O)NC(=O)C(C)N1CCC(C)CC1
InChIInChI=1S/C12H23N3O2/c1-4-13-12(17)14-11(16)10(3)15-7-5-9(2)6-8-15/h9-10H,4-8H2,1-3H3,(H2,13,14,16,17)
InChIKeyHCSRINMUJLVJGR-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

methyl 1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidine-4-carboxylate
CID 60638894
(2R)-2-[4-(1,3-dioxolan-2-yl)piperidin-1-yl]-N-(ethylcarbamoyl)propanamide
CID 95269319
2-(3-aminopyrrolidin-1-yl)-N-(ethylcarbamoyl)propanamide;hydrochloride
CID 119917700
N-(ethylcarbamoyl)-2-piperazin-1-ylpropanamide
CID 43089574
(2R)-2-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-N-(ethylcarbamoyl)propanamide
CID 11931790
N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide
CID 63282323
N-ethyl-2-(3-methylpyrrolidin-1-yl)propanamide
CID 130606422
2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide
CID 81460901
(2R)-N-(ethylcarbamoyl)-2-(4-ethylsulfonylpiperazin-1-yl)propanamide
CID 94418975
2-[4-(cyclohexanecarbonyl)piperazin-1-yl]-N-(ethylcarbamoyl)propanamide
CID 51094827
(2S)-2-[4-(cyclohexanecarbonyl)piperazin-1-yl]-N-(ethylcarbamoyl)propanamide
CID 94812868
(3S,4S)-1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]-4-methylpyrrolidine-3-carboxylic acid
CID 114086173

Frequently Asked Questions

What is the IUPAC name of N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide?
The IUPAC name of N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide (CID 46614180) is N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide.
What is the SMILES notation for N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide?
The canonical SMILES for N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide is CCNC(=O)NC(=O)C(C)N1CCC(C)CC1.
What is the InChIKey of N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide?
The InChIKey is HCSRINMUJLVJGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-4-13-12(17)14-11(16)10(3)15-7-5-9(2)6-8-15/h9-10H,4-8H2,1-3H3,(H2,13,14,16,17).
What are the key properties of N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide?
N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide 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 N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide is sourced from PubChem (CID 46614180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).