1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide

C17H32N2O2 — CID 113005874

IUPAC1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide
SMILESCCCCC(=O)N1CCC(C(=O)N(CCC)CCC)CC1
InChIInChI=1S/C17H32N2O2/c1-4-7-8-16(20)18-13-9-15(10-14-18)17(21)19(11-5-2)12-6-3/h15H,4-14H2,1-3H3
InChIKeyUHLGRYCEDOMGMK-UHFFFAOYSA-N
MW296.45 g/mol
LogP3.06
Rot. Bonds8

About 1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide

1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide (PubChem CID 113005874) has the molecular formula C17H32N2O2 and a molecular weight of 296.45 g/mol. Its IUPAC name is 1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide
PubChem CID113005874
Molecular FormulaC17H32N2O2
Molecular Weight296.45 g/mol
Exact Mass296.25
IUPAC Name1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide
SMILESCCCCC(=O)N1CCC(C(=O)N(CCC)CCC)CC1
InChIInChI=1S/C17H32N2O2/c1-4-7-8-16(20)18-13-9-15(10-14-18)17(21)19(11-5-2)12-6-3/h15H,4-14H2,1-3H3
InChIKeyUHLGRYCEDOMGMK-UHFFFAOYSA-N
XLogP3.06
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.45
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide?
The IUPAC name of 1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide (CID 113005874) is 1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide.
What is the SMILES notation for 1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide?
The canonical SMILES for 1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide is CCCCC(=O)N1CCC(C(=O)N(CCC)CCC)CC1.
What is the InChIKey of 1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide?
The InChIKey is UHLGRYCEDOMGMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O2/c1-4-7-8-16(20)18-13-9-15(10-14-18)17(21)19(11-5-2)12-6-3/h15H,4-14H2,1-3H3.
What are the key properties of 1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide?
1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide has a molecular weight of 296.45 g/mol, XLogP of 3.06, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pentanoyl-N,N-dipropylpiperidine-4-carboxamide is sourced from PubChem (CID 113005874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).