3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide

C18H26N2O3 — CID 110819514

IUPAC3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide
SMILESCCCCC(=O)N1CCC(NC(=O)c2cccc(OC)c2)CC1
InChIInChI=1S/C18H26N2O3/c1-3-4-8-17(21)20-11-9-15(10-12-20)19-18(22)14-6-5-7-16(13-14)23-2/h5-7,13,15H,3-4,8-12H2,1-2H3,(H,19,22)
InChIKeyNEUWADZXZLNMOF-UHFFFAOYSA-N
MW318.42 g/mol
LogP2.61
Rot. Bonds6

About 3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide

3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide (PubChem CID 110819514) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is 3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide.

Molecular Properties

Compound Name3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide
PubChem CID110819514
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC Name3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide
SMILESCCCCC(=O)N1CCC(NC(=O)c2cccc(OC)c2)CC1
InChIInChI=1S/C18H26N2O3/c1-3-4-8-17(21)20-11-9-15(10-12-20)19-18(22)14-6-5-7-16(13-14)23-2/h5-7,13,15H,3-4,8-12H2,1-2H3,(H,19,22)
InChIKeyNEUWADZXZLNMOF-UHFFFAOYSA-N
XLogP2.61
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

butyl 4-[(3-methoxybenzoyl)amino]piperidine-1-carboxylate
CID 108559738
N-[1-(3,3-dimethylbutanoyl)piperidin-4-yl]-3-methoxybenzamide
CID 110822246
N-[1-[4-(1,3-dioxoisoindol-2-yl)butanoyl]piperidin-4-yl]-3-methoxybenzamide
CID 108550367
N-[1-[3-(3-methoxyphenyl)propanoyl]piperidin-4-yl]benzamide
CID 24575446
3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide
CID 108550372
N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-3-methoxybenzamide
CID 110819864
N-cyclopropyl-3-methoxybenzamide
CID 900156
3-hydroxy-N-[1-(3-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108558264
3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide
CID 108550302
3-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]benzamide
CID 71784695
4-[(3-methoxybenzoyl)amino]-N-phenylpiperidine-1-carboxamide
CID 43814029
N-[1-[3-(3-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide
CID 47836658

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide?
The IUPAC name of 3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide (CID 110819514) is 3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide.
What is the SMILES notation for 3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide?
The canonical SMILES for 3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide is CCCCC(=O)N1CCC(NC(=O)c2cccc(OC)c2)CC1.
What is the InChIKey of 3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide?
The InChIKey is NEUWADZXZLNMOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-3-4-8-17(21)20-11-9-15(10-12-20)19-18(22)14-6-5-7-16(13-14)23-2/h5-7,13,15H,3-4,8-12H2,1-2H3,(H,19,22).
What are the key properties of 3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide?
3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide has a molecular weight of 318.42 g/mol, XLogP of 2.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide is sourced from PubChem (CID 110819514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).