N-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide

C17H26N2O — CID 58673088

IUPACN-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide
SMILESCCC(=O)N(c1ccccc1)C1(C)CCN(CC)CC1
InChIInChI=1S/C17H26N2O/c1-4-16(20)19(15-9-7-6-8-10-15)17(3)11-13-18(5-2)14-12-17/h6-10H,4-5,11-14H2,1-3H3
InChIKeyCNDOSCZOHZXVAH-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.30
Rot. Bonds4

About N-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide

N-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide (PubChem CID 58673088) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide.

Molecular Properties

Compound NameN-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide
PubChem CID58673088
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide
SMILESCCC(=O)N(c1ccccc1)C1(C)CCN(CC)CC1
InChIInChI=1S/C17H26N2O/c1-4-16(20)19(15-9-7-6-8-10-15)17(3)11-13-18(5-2)14-12-17/h6-10H,4-5,11-14H2,1-3H3
InChIKeyCNDOSCZOHZXVAH-UHFFFAOYSA-N
XLogP3.30
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide?
The IUPAC name of N-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide (CID 58673088) is N-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide.
What is the SMILES notation for N-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide?
The canonical SMILES for N-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide is CCC(=O)N(c1ccccc1)C1(C)CCN(CC)CC1.
What is the InChIKey of N-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide?
The InChIKey is CNDOSCZOHZXVAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-4-16(20)19(15-9-7-6-8-10-15)17(3)11-13-18(5-2)14-12-17/h6-10H,4-5,11-14H2,1-3H3.
What are the key properties of N-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide?
N-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide has a molecular weight of 274.41 g/mol, XLogP of 3.30, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-4-methylpiperidin-4-yl)-N-phenylpropanamide is sourced from PubChem (CID 58673088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).