(2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide

C21H21N3O3 — CID 8755514

IUPAC(2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide
SMILESCNC(=O)NC(=O)[C@H](N[C@H](c1ccccc1)c1ccco1)c1ccccc1
InChIInChI=1S/C21H21N3O3/c1-22-21(26)24-20(25)19(16-11-6-3-7-12-16)23-18(17-13-8-14-27-17)15-9-4-2-5-10-15/h2-14,18-19,23H,1H3,(H2,22,24,25,26)/t18-,19-/m1/s1
InChIKeyKRTPRIPXJFFDQN-RTBURBONSA-N
MW363.42 g/mol
LogP3.16
Rot. Bonds6

About (2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide

(2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide (PubChem CID 8755514) has the molecular formula C21H21N3O3 and a molecular weight of 363.42 g/mol. Its IUPAC name is (2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide
PubChem CID8755514
Molecular FormulaC21H21N3O3
Molecular Weight363.42 g/mol
Exact Mass363.16
IUPAC Name(2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide
SMILESCNC(=O)NC(=O)[C@H](N[C@H](c1ccccc1)c1ccco1)c1ccccc1
InChIInChI=1S/C21H21N3O3/c1-22-21(26)24-20(25)19(16-11-6-3-7-12-16)23-18(17-13-8-14-27-17)15-9-4-2-5-10-15/h2-14,18-19,23H,1H3,(H2,22,24,25,26)/t18-,19-/m1/s1
InChIKeyKRTPRIPXJFFDQN-RTBURBONSA-N
XLogP3.16
TPSA83.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 53.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-N-carbamoyl-2-[[(S)-furan-2-yl(phenyl)methyl]amino]-2-phenylacetamide
CID 8755898
(2S)-2-[[(2S)-4-(furan-2-yl)butan-2-yl]amino]-N-(methylcarbamoyl)-2-phenylacetamide
CID 31297357
2-[[(S)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)acetamide
CID 8755288
(2S)-N-cyclopropyl-2-[[(S)-furan-2-yl(phenyl)methyl]amino]-2-phenylacetamide
CID 8756132
(2S)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(4-methylphenyl)-2-phenylacetamide
CID 8755134
(2R)-2-[[(S)-furan-2-yl(phenyl)methyl]amino]-N,N-dimethyl-2-phenylacetamide
CID 8756342
(2S)-N-(4-fluorophenyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-2-phenylacetamide
CID 8755424
(2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-methoxyphenyl)-2-phenylacetamide
CID 8696252
(2S)-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide
CID 9356593
(2R)-2-[[(1S)-1-(furan-2-yl)ethyl]amino]-N-(methylcarbamoyl)propanamide
CID 8919781
3-[[furan-2-yl(phenyl)methyl]amino]butanamide
CID 115573315
2-[[furan-2-yl(phenyl)methyl]amino]pentanoic acid
CID 65055569

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide?
The IUPAC name of (2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide (CID 8755514) is (2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide.
What is the SMILES notation for (2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide?
The canonical SMILES for (2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide is CNC(=O)NC(=O)[C@H](N[C@H](c1ccccc1)c1ccco1)c1ccccc1.
What is the InChIKey of (2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide?
The InChIKey is KRTPRIPXJFFDQN-RTBURBONSA-N. The full InChI is InChI=1S/C21H21N3O3/c1-22-21(26)24-20(25)19(16-11-6-3-7-12-16)23-18(17-13-8-14-27-17)15-9-4-2-5-10-15/h2-14,18-19,23H,1H3,(H2,22,24,25,26)/t18-,19-/m1/s1.
What are the key properties of (2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide?
(2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide has a molecular weight of 363.42 g/mol, XLogP of 3.16, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)-2-phenylacetamide is sourced from PubChem (CID 8755514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).