5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide

C14H21BrN2O2 — CID 61343308

IUPAC5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide
SMILESCN(C)CCN(C(=O)c1ccc(Br)o1)C1CCCC1
InChIInChI=1S/C14H21BrN2O2/c1-16(2)9-10-17(11-5-3-4-6-11)14(18)12-7-8-13(15)19-12/h7-8,11H,3-6,9-10H2,1-2H3
InChIKeyIJODVTMXULUWAT-UHFFFAOYSA-N
MW329.24 g/mol
LogP2.99
Rot. Bonds5

About 5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide

5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide (PubChem CID 61343308) has the molecular formula C14H21BrN2O2 and a molecular weight of 329.24 g/mol. Its IUPAC name is 5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide
PubChem CID61343308
Molecular FormulaC14H21BrN2O2
Molecular Weight329.24 g/mol
Exact Mass328.08
IUPAC Name5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide
SMILESCN(C)CCN(C(=O)c1ccc(Br)o1)C1CCCC1
InChIInChI=1S/C14H21BrN2O2/c1-16(2)9-10-17(11-5-3-4-6-11)14(18)12-7-8-13(15)19-12/h7-8,11H,3-6,9-10H2,1-2H3
InChIKeyIJODVTMXULUWAT-UHFFFAOYSA-N
XLogP2.99
TPSA36.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.24
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-cyclobutyl-N-(3-hydroxypropyl)furan-2-carboxamide
CID 102862780
5-bromo-N-cyclopentyl-N-(2-methylpropyl)furan-2-carboxamide
CID 112725800
5-bromo-N-cyclopropyl-N-ethylfuran-2-carboxamide
CID 60729086
5-bromo-N-cyclopropyl-N-(3-methylbutyl)furan-2-carboxamide
CID 60733156
5-bromo-N-cyclopentyl-N-prop-2-enylfuran-2-carboxamide
CID 61062387
5-bromo-N-cyclopentyl-N-(furan-2-ylmethyl)furan-2-carboxamide
CID 60738196
5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide
CID 102632344
(2S)-3-[(5-bromofuran-2-carbonyl)-cyclopropylamino]-2-methylpropanoic acid
CID 99851755
3-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]benzamide
CID 60954447
N-(2-chloroethyl)-N-cyclopentyl-5-ethylfuran-2-carboxamide
CID 79084217
5-bromo-N-cyclopropyl-N-[(4-fluorophenyl)methyl]furan-2-carboxamide
CID 60666540
5-bromo-N-methyl-N-(4-methylcyclohexyl)furan-2-carboxamide
CID 55028576

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide?
The IUPAC name of 5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide (CID 61343308) is 5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide.
What is the SMILES notation for 5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide?
The canonical SMILES for 5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide is CN(C)CCN(C(=O)c1ccc(Br)o1)C1CCCC1.
What is the InChIKey of 5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide?
The InChIKey is IJODVTMXULUWAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21BrN2O2/c1-16(2)9-10-17(11-5-3-4-6-11)14(18)12-7-8-13(15)19-12/h7-8,11H,3-6,9-10H2,1-2H3.
What are the key properties of 5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide?
5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide has a molecular weight of 329.24 g/mol, XLogP of 2.99, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide is sourced from PubChem (CID 61343308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).