N-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide

C16H15Cl2NO3 — CID 95756198

IUPACN-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide
SMILESO=C(NCC1CC1)c1ccc(COc2cccc(Cl)c2Cl)o1
InChIInChI=1S/C16H15Cl2NO3/c17-12-2-1-3-13(15(12)18)21-9-11-6-7-14(22-11)16(20)19-8-10-4-5-10/h1-3,6-7,10H,4-5,8-9H2,(H,19,20)
InChIKeyRZZVDUGAMIJBDW-UHFFFAOYSA-N
MW340.21 g/mol
LogP4.31
Rot. Bonds6

About N-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide

N-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide (PubChem CID 95756198) has the molecular formula C16H15Cl2NO3 and a molecular weight of 340.21 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide
PubChem CID95756198
Molecular FormulaC16H15Cl2NO3
Molecular Weight340.21 g/mol
Exact Mass339.04
IUPAC NameN-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide
SMILESO=C(NCC1CC1)c1ccc(COc2cccc(Cl)c2Cl)o1
InChIInChI=1S/C16H15Cl2NO3/c17-12-2-1-3-13(15(12)18)21-9-11-6-7-14(22-11)16(20)19-8-10-4-5-10/h1-3,6-7,10H,4-5,8-9H2,(H,19,20)
InChIKeyRZZVDUGAMIJBDW-UHFFFAOYSA-N
XLogP4.31
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.21
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butyl-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide
CID 19415847
5-[(2,3-dichlorophenoxy)methyl]-N-(3,3-dimethyl-2-oxobutyl)furan-2-carboxamide
CID 95753507
N-(cyclobutylmethyl)-5-[(2-methylphenoxy)methyl]furan-2-carboxamide
CID 95756411
N-(cyclopropylmethyl)-5-[(2-prop-2-enylphenoxy)methyl]furan-2-carboxamide
CID 95756196
5-[(2,3-dichlorophenoxy)methyl]-N-(3-methoxyphenyl)furan-2-carboxamide
CID 19415701
5-[(2,3-dichlorophenoxy)methyl]-N-[2-(difluoromethoxy)phenyl]furan-2-carboxamide
CID 19415778
ethyl (2R)-2-[[5-[(2,3-dichlorophenoxy)methyl]furan-2-carbonyl]amino]-3-sulfanylpropanoate
CID 19415733
N-(2-chloro-5-nitrophenyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide
CID 19415750
5-[(2-chlorophenoxy)methyl]-N-[(3,4-dichlorophenyl)methyl]furan-2-carboxamide
CID 4139417
5-[(2-chlorophenoxy)methyl]-N-(3,3-dimethyl-2-oxobutyl)furan-2-carboxamide
CID 95753482
(E)-1-cyclopropyl-3-[5-[(2,3-dichlorophenoxy)methyl]furan-2-yl]prop-2-en-1-one
CID 19558880
5-[(2,3-dichlorophenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide
CID 19415760

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide (CID 95756198) is N-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide is O=C(NCC1CC1)c1ccc(COc2cccc(Cl)c2Cl)o1.
What is the InChIKey of N-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide?
The InChIKey is RZZVDUGAMIJBDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO3/c17-12-2-1-3-13(15(12)18)21-9-11-6-7-14(22-11)16(20)19-8-10-4-5-10/h1-3,6-7,10H,4-5,8-9H2,(H,19,20).
What are the key properties of N-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide?
N-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide has a molecular weight of 340.21 g/mol, XLogP of 4.31, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-5-[(2,3-dichlorophenoxy)methyl]furan-2-carboxamide is sourced from PubChem (CID 95756198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).