5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide

C13H17BrN2O2 — CID 60730594

IUPAC5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide
SMILESO=C(NC1CCN(C2CC2)CC1)c1ccc(Br)o1
InChIInChI=1S/C13H17BrN2O2/c14-12-4-3-11(18-12)13(17)15-9-5-7-16(8-6-9)10-1-2-10/h3-4,9-10H,1-2,5-8H2,(H,15,17)
InChIKeyNAKDZJCJXCLPPL-UHFFFAOYSA-N
MW313.19 g/mol
LogP2.40
Rot. Bonds3

About 5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide

5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide (PubChem CID 60730594) has the molecular formula C13H17BrN2O2 and a molecular weight of 313.19 g/mol. Its IUPAC name is 5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide
PubChem CID60730594
Molecular FormulaC13H17BrN2O2
Molecular Weight313.19 g/mol
Exact Mass312.05
IUPAC Name5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide
SMILESO=C(NC1CCN(C2CC2)CC1)c1ccc(Br)o1
InChIInChI=1S/C13H17BrN2O2/c14-12-4-3-11(18-12)13(17)15-9-5-7-16(8-6-9)10-1-2-10/h3-4,9-10H,1-2,5-8H2,(H,15,17)
InChIKeyNAKDZJCJXCLPPL-UHFFFAOYSA-N
XLogP2.40
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.19
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-cyclododecylfuran-2-carboxamide
CID 2072742
4-[(5-bromofuran-2-carbonyl)amino]-N,N-dimethylpiperidine-1-carboxamide
CID 108560310
N-(4-aminocyclohexyl)-5-bromofuran-2-carboxamide;hydrochloride
CID 119474938
5-bromo-N-[4-[[4-[(5-bromofuran-2-carbonyl)amino]cyclohexyl]methyl]cyclohexyl]furan-2-carboxamide
CID 1083377
5-bromo-N-[(3R)-1-cyclopropyl-5-oxopyrrolidin-3-yl]furan-2-carboxamide
CID 95969243
5-bromo-N-[1-(furan-3-carbonyl)piperidin-4-yl]furan-2-carboxamide
CID 38198333
5-bromo-N-[1-(2-phenylacetyl)piperidin-4-yl]furan-2-carboxamide
CID 108551717
N-(1-azabicyclo[3.2.1]octan-3-yl)-5-bromofuran-2-carboxamide
CID 22350324
5-bromo-N-[1-(4-tert-butylbenzoyl)piperidin-4-yl]furan-2-carboxamide
CID 108551736
methyl 4-[(5-bromofuran-2-carbonyl)amino]cyclohexane-1-carboxylate
CID 112690033
5-bromo-N-[1-(pyridine-2-carbonyl)piperidin-4-yl]furan-2-carboxamide
CID 108551769
5-bromo-N-[1-(6-oxo-1H-pyridazine-3-carbonyl)piperidin-4-yl]furan-2-carboxamide
CID 108551744

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide?
The IUPAC name of 5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide (CID 60730594) is 5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide?
The canonical SMILES for 5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide is O=C(NC1CCN(C2CC2)CC1)c1ccc(Br)o1.
What is the InChIKey of 5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide?
The InChIKey is NAKDZJCJXCLPPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17BrN2O2/c14-12-4-3-11(18-12)13(17)15-9-5-7-16(8-6-9)10-1-2-10/h3-4,9-10H,1-2,5-8H2,(H,15,17).
What are the key properties of 5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide?
5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide has a molecular weight of 313.19 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(1-cyclopropylpiperidin-4-yl)furan-2-carboxamide is sourced from PubChem (CID 60730594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).