(2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide

C15H16Cl2N2O2 — CID 9334007

IUPAC(2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide
SMILESC[C@H](C(=O)Nc1ccc(Cl)cc1Cl)N(C)Cc1ccco1
InChIInChI=1S/C15H16Cl2N2O2/c1-10(19(2)9-12-4-3-7-21-12)15(20)18-14-6-5-11(16)8-13(14)17/h3-8,10H,9H2,1-2H3,(H,18,20)/t10-/m1/s1
InChIKeyMKVUIBQSEJLRGZ-SNVBAGLBSA-N
MW327.21 g/mol
LogP4.05
Rot. Bonds5

About (2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide

(2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide (PubChem CID 9334007) has the molecular formula C15H16Cl2N2O2 and a molecular weight of 327.21 g/mol. Its IUPAC name is (2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide.

Molecular Properties

Compound Name(2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide
PubChem CID9334007
Molecular FormulaC15H16Cl2N2O2
Molecular Weight327.21 g/mol
Exact Mass326.06
IUPAC Name(2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide
SMILESC[C@H](C(=O)Nc1ccc(Cl)cc1Cl)N(C)Cc1ccco1
InChIInChI=1S/C15H16Cl2N2O2/c1-10(19(2)9-12-4-3-7-21-12)15(20)18-14-6-5-11(16)8-13(14)17/h3-8,10H,9H2,1-2H3,(H,18,20)/t10-/m1/s1
InChIKeyMKVUIBQSEJLRGZ-SNVBAGLBSA-N
XLogP4.05
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.21
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide
CID 43526612
3-(2,4-dichlorophenyl)-1-(furan-2-ylmethyl)-1-methylurea
CID 5015245
N-(4-amino-2-methylphenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide
CID 43526601
(2S)-2-[furan-2-ylmethyl(methyl)amino]-N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]propanamide
CID 26518608
N-(2,4-dichlorophenyl)-3-[furan-2-ylmethyl(methylsulfonyl)amino]propanamide
CID 113138586
(2R)-N-(2,5-dichlorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]propanamide
CID 8516902
N-(2,3-dihydro-1H-inden-5-yl)-2-[furan-2-ylmethyl(methyl)amino]propanamide
CID 17403152
2-[furan-2-ylmethyl(methyl)amino]-N-(4-nitrophenyl)propanamide
CID 51171787
N-(2,4-dichlorophenyl)-2-[methyl-[(4-oxo-3H-quinazolin-2-yl)methyl]amino]propanamide
CID 135462208
N-(2-amino-4-chlorophenyl)-2-[methyl(3-methylbutyl)amino]propanamide
CID 61425953
[(2R)-1-(2,4-dichloroanilino)-1-oxopropan-2-yl] furan-2-carboxylate
CID 2386762
N-(4-chloro-2-methylphenyl)-2-[furan-2-ylmethyl-[(2-hydroxyphenyl)methyl]amino]acetamide
CID 78821266

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide?
The IUPAC name of (2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide (CID 9334007) is (2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide.
What is the SMILES notation for (2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide?
The canonical SMILES for (2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide is C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)N(C)Cc1ccco1.
What is the InChIKey of (2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide?
The InChIKey is MKVUIBQSEJLRGZ-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H16Cl2N2O2/c1-10(19(2)9-12-4-3-7-21-12)15(20)18-14-6-5-11(16)8-13(14)17/h3-8,10H,9H2,1-2H3,(H,18,20)/t10-/m1/s1.
What are the key properties of (2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide?
(2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide has a molecular weight of 327.21 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2,4-dichlorophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide is sourced from PubChem (CID 9334007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).