N-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide

C13H20N2O2 — CID 66181383

IUPACN-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide
SMILESCCCN(C(=O)c1cc(C)oc1C)C1CNC1
InChIInChI=1S/C13H20N2O2/c1-4-5-15(11-7-14-8-11)13(16)12-6-9(2)17-10(12)3/h6,11,14H,4-5,7-8H2,1-3H3
InChIKeyOVERVRPVZHDXSR-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.72
Rot. Bonds4

About N-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide

N-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide (PubChem CID 66181383) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide
PubChem CID66181383
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide
SMILESCCCN(C(=O)c1cc(C)oc1C)C1CNC1
InChIInChI=1S/C13H20N2O2/c1-4-5-15(11-7-14-8-11)13(16)12-6-9(2)17-10(12)3/h6,11,14H,4-5,7-8H2,1-3H3
InChIKeyOVERVRPVZHDXSR-UHFFFAOYSA-N
XLogP1.72
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2,5-dimethyl-N-pyrrolidin-3-ylfuran-3-carboxamide
CID 60807715
N-(2-chloroethyl)-N-cyclobutyl-2,5-dimethylfuran-3-carboxamide
CID 102872648
N-(azetidin-3-yl)-3,6-dimethyl-N-propylpyridazine-4-carboxamide
CID 113439411
2-[cyclopropyl-(2,5-dimethylfuran-3-carbonyl)amino]acetic acid
CID 54945910
N-(azetidin-3-yl)-2-hydroxy-3-methyl-N-propylbenzamide
CID 66184160
N-(azetidin-3-yl)-3,4-dimethyl-N-propylbenzamide
CID 66215454
3,5-dimethyl-N-piperidin-4-yl-N-propylfuran-2-carboxamide
CID 119823817
N-[3-[[(2R)-butan-2-yl]amino]-3-oxopropyl]-N-cyclopropyl-2,5-dimethylfuran-3-carboxamide
CID 7225250
N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide
CID 66183740
N-(azetidin-3-yl)-N-propylnaphthalene-1-carboxamide
CID 66182458
N-(azetidin-3-yl)-2,3,4-trifluoro-N-propylbenzamide
CID 79749886
N-(azetidin-3-yl)-5-chloro-2-iodo-N-propylbenzamide
CID 114030457

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide?
The IUPAC name of N-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide (CID 66181383) is N-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide.
What is the SMILES notation for N-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide?
The canonical SMILES for N-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide is CCCN(C(=O)c1cc(C)oc1C)C1CNC1.
What is the InChIKey of N-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide?
The InChIKey is OVERVRPVZHDXSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-4-5-15(11-7-14-8-11)13(16)12-6-9(2)17-10(12)3/h6,11,14H,4-5,7-8H2,1-3H3.
What are the key properties of N-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide?
N-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide has a molecular weight of 236.31 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide is sourced from PubChem (CID 66181383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).