(2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide

C15H17ClN2O2 — CID 8857548

IUPAC(2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide
SMILESC[C@H](C(N)=O)N(C)Cc1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C15H17ClN2O2/c1-10(15(17)19)18(2)9-13-7-8-14(20-13)11-3-5-12(16)6-4-11/h3-8,10H,9H2,1-2H3,(H2,17,19)/t10-/m1/s1
InChIKeyYEGYBEPBFQCEMU-SNVBAGLBSA-N
MW292.77 g/mol
LogP2.91
Rot. Bonds5

About (2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide

(2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide (PubChem CID 8857548) has the molecular formula C15H17ClN2O2 and a molecular weight of 292.77 g/mol. Its IUPAC name is (2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide.

Molecular Properties

Compound Name(2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide
PubChem CID8857548
Molecular FormulaC15H17ClN2O2
Molecular Weight292.77 g/mol
Exact Mass292.10
IUPAC Name(2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide
SMILESC[C@H](C(N)=O)N(C)Cc1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C15H17ClN2O2/c1-10(15(17)19)18(2)9-13-7-8-14(20-13)11-3-5-12(16)6-4-11/h3-8,10H,9H2,1-2H3,(H2,17,19)/t10-/m1/s1
InChIKeyYEGYBEPBFQCEMU-SNVBAGLBSA-N
XLogP2.91
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.77
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]-N-(methylcarbamoyl)propanamide
CID 42883929
1-[5-(4-chlorophenyl)furan-2-yl]-N,N-dimethylmethanamine;hydrochloride
CID 131862742
2-[[5-(4-fluorophenyl)furan-2-yl]methyl-methylamino]propanoic acid
CID 122036744
[2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]-2-oxoethyl]-[2-(methylamino)-2-oxoethyl]azanium
CID 8772515
[2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]-2-oxoethyl]-[(1S)-1-(furan-2-yl)ethyl]azanium
CID 8921213
N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-N-methylprop-2-yn-1-amine
CID 21388068
N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-N-methyl-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethanamine
CID 17392897
(2S)-2-[(3,5-dichlorophenyl)methyl-methylamino]propanamide
CID 94190668
(2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide
CID 33475058
[2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]-2-oxoethyl] 1H-pyrrole-2-carboxylate
CID 8550305
2-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]propanoic acid
CID 62637417
N'-[2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]acetyl]benzohydrazide
CID 9435447

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide?
The IUPAC name of (2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide (CID 8857548) is (2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide.
What is the SMILES notation for (2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide?
The canonical SMILES for (2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide is C[C@H](C(N)=O)N(C)Cc1ccc(-c2ccc(Cl)cc2)o1.
What is the InChIKey of (2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide?
The InChIKey is YEGYBEPBFQCEMU-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H17ClN2O2/c1-10(15(17)19)18(2)9-13-7-8-14(20-13)11-3-5-12(16)6-4-11/h3-8,10H,9H2,1-2H3,(H2,17,19)/t10-/m1/s1.
What are the key properties of (2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide?
(2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide has a molecular weight of 292.77 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[5-(4-chlorophenyl)furan-2-yl]methyl-methylamino]propanamide is sourced from PubChem (CID 8857548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).