2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide

C12H22N2O2 — CID 60769090

IUPAC2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide
SMILESCCC(=O)N1CCC(NC(=O)C(C)C)CC1
InChIInChI=1S/C12H22N2O2/c1-4-11(15)14-7-5-10(6-8-14)13-12(16)9(2)3/h9-10H,4-8H2,1-3H3,(H,13,16)
InChIKeyIAWKTNWATJLSHY-UHFFFAOYSA-N
MW226.32 g/mol
LogP1.16
Rot. Bonds3

About 2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide

2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide (PubChem CID 60769090) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide
PubChem CID60769090
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide
SMILESCCC(=O)N1CCC(NC(=O)C(C)C)CC1
InChIInChI=1S/C12H22N2O2/c1-4-11(15)14-7-5-10(6-8-14)13-12(16)9(2)3/h9-10H,4-8H2,1-3H3,(H,13,16)
InChIKeyIAWKTNWATJLSHY-UHFFFAOYSA-N
XLogP1.16
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methylpropyl N-(1-propanoylpiperidin-4-yl)carbamate
CID 108566379
N-[1-(5-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide
CID 82011596
N-[1-(6-aminohexanoyl)piperidin-4-yl]-2-methylpropanamide
CID 60947434
1-[4-(1-bromoethyl)piperidin-1-yl]propan-1-one
CID 106839427
1-[4-(ethylamino)piperidin-1-yl]propan-1-one
CID 60818400
N-[1-[2-(2-aminoethoxy)acetyl]piperidin-4-yl]-2-methylpropanamide
CID 79473160
N-[1-[2-(2-chlorophenyl)acetyl]piperidin-4-yl]-2-methylpropanamide
CID 110822854
2-methyl-N-[1-[3-(4-propan-2-ylpiperazin-1-yl)propanoyl]piperidin-4-yl]propanamide
CID 164715646
2-methyl-N-[1-(3-methylbut-2-enoyl)piperidin-4-yl]propanamide
CID 113223568
2-methyl-N-[4-(2-methylpropanoylamino)cyclohexyl]propanamide
CID 5083762
2-methyl-N-[1-(2-pyrrolidin-2-ylacetyl)piperidin-4-yl]propanamide;hydrochloride
CID 119734420
N-(1-propanoylpiperidin-4-yl)formamide
CID 87856562

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide?
The IUPAC name of 2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide (CID 60769090) is 2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide?
The canonical SMILES for 2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide is CCC(=O)N1CCC(NC(=O)C(C)C)CC1.
What is the InChIKey of 2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide?
The InChIKey is IAWKTNWATJLSHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-4-11(15)14-7-5-10(6-8-14)13-12(16)9(2)3/h9-10H,4-8H2,1-3H3,(H,13,16).
What are the key properties of 2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide?
2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide has a molecular weight of 226.32 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide is sourced from PubChem (CID 60769090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).