(2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide

C20H19ClN2O2 — CID 8755484

IUPAC(2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide
SMILESC[C@@H](N[C@H](c1ccccc1)c1ccco1)C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C20H19ClN2O2/c1-14(20(24)23-17-11-9-16(21)10-12-17)22-19(18-8-5-13-25-18)15-6-3-2-4-7-15/h2-14,19,22H,1H3,(H,23,24)/t14-,19-/m1/s1
InChIKeyCVXBZTFLSDBXHV-AUUYWEPGSA-N
MW354.84 g/mol
LogP4.64
Rot. Bonds6

About (2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide

(2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide (PubChem CID 8755484) has the molecular formula C20H19ClN2O2 and a molecular weight of 354.84 g/mol. Its IUPAC name is (2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide.

Molecular Properties

Compound Name(2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide
PubChem CID8755484
Molecular FormulaC20H19ClN2O2
Molecular Weight354.84 g/mol
Exact Mass354.11
IUPAC Name(2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide
SMILESC[C@@H](N[C@H](c1ccccc1)c1ccco1)C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C20H19ClN2O2/c1-14(20(24)23-17-11-9-16(21)10-12-17)22-19(18-8-5-13-25-18)15-6-3-2-4-7-15/h2-14,19,22H,1H3,(H,23,24)/t14-,19-/m1/s1
InChIKeyCVXBZTFLSDBXHV-AUUYWEPGSA-N
XLogP4.64
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.84
LogP ≤ 54.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide?
The IUPAC name of (2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide (CID 8755484) is (2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide.
What is the SMILES notation for (2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide?
The canonical SMILES for (2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide is C[C@@H](N[C@H](c1ccccc1)c1ccco1)C(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of (2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide?
The InChIKey is CVXBZTFLSDBXHV-AUUYWEPGSA-N. The full InChI is InChI=1S/C20H19ClN2O2/c1-14(20(24)23-17-11-9-16(21)10-12-17)22-19(18-8-5-13-25-18)15-6-3-2-4-7-15/h2-14,19,22H,1H3,(H,23,24)/t14-,19-/m1/s1.
What are the key properties of (2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide?
(2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide has a molecular weight of 354.84 g/mol, XLogP of 4.64, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-chlorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]propanamide is sourced from PubChem (CID 8755484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).