N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide

C15H21BrN2O3 — CID 108555501

IUPACN-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide
SMILESCCCCC(=O)NC1CCN(C(=O)c2ccc(Br)o2)CC1
InChIInChI=1S/C15H21BrN2O3/c1-2-3-4-14(19)17-11-7-9-18(10-8-11)15(20)12-5-6-13(16)21-12/h5-6,11H,2-4,7-10H2,1H3,(H,17,19)
InChIKeyFAXWZTVFDLHUEX-UHFFFAOYSA-N
MW357.25 g/mol
LogP2.95
Rot. Bonds5

About N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide

N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide (PubChem CID 108555501) has the molecular formula C15H21BrN2O3 and a molecular weight of 357.25 g/mol. Its IUPAC name is N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide.

Molecular Properties

Compound NameN-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide
PubChem CID108555501
Molecular FormulaC15H21BrN2O3
Molecular Weight357.25 g/mol
Exact Mass356.07
IUPAC NameN-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide
SMILESCCCCC(=O)NC1CCN(C(=O)c2ccc(Br)o2)CC1
InChIInChI=1S/C15H21BrN2O3/c1-2-3-4-14(19)17-11-7-9-18(10-8-11)15(20)12-5-6-13(16)21-12/h5-6,11H,2-4,7-10H2,1H3,(H,17,19)
InChIKeyFAXWZTVFDLHUEX-UHFFFAOYSA-N
XLogP2.95
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.25
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 4-[[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]amino]-4-oxobutanoate
CID 108564540
N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]-4-(4-methylphenoxy)butanamide
CID 108553427
tert-butyl N-[3-[[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]amino]-3-oxopropyl]carbamate
CID 108548249
(5-bromofuran-2-yl)-[4-(methylamino)piperidin-1-yl]methanone
CID 119560232
(5-bromofuran-2-yl)-[4-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119560231
N-[1-(2-methylbenzoyl)piperidin-4-yl]pentanamide
CID 110820234
(5-bromofuran-2-yl)-(4-propylazepan-1-yl)methanone
CID 49008152
[4-(1-bromoethyl)piperidin-1-yl]-(5-bromofuran-2-yl)methanone
CID 106839225
N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]-3,4,5-trihydroxybenzamide
CID 108551489
N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pentanamide
CID 108561888
1-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]ethanone
CID 84581067
(5-bromofuran-2-yl)-[4-(bromomethyl)piperidin-1-yl]methanone
CID 80678565

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide?
The IUPAC name of N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide (CID 108555501) is N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide.
What is the SMILES notation for N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide?
The canonical SMILES for N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide is CCCCC(=O)NC1CCN(C(=O)c2ccc(Br)o2)CC1.
What is the InChIKey of N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide?
The InChIKey is FAXWZTVFDLHUEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21BrN2O3/c1-2-3-4-14(19)17-11-7-9-18(10-8-11)15(20)12-5-6-13(16)21-12/h5-6,11H,2-4,7-10H2,1H3,(H,17,19).
What are the key properties of N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide?
N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide has a molecular weight of 357.25 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-bromofuran-2-carbonyl)piperidin-4-yl]pentanamide is sourced from PubChem (CID 108555501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).