(2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide

C22H24N2O2 — CID 9102051

IUPAC(2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide
SMILESCc1ccc(CN(C)[C@@H](C)C(=O)Nc2ccccc2-c2ccccc2)o1
InChIInChI=1S/C22H24N2O2/c1-16-13-14-19(26-16)15-24(3)17(2)22(25)23-21-12-8-7-11-20(21)18-9-5-4-6-10-18/h4-14,17H,15H2,1-3H3,(H,23,25)/t17-/m0/s1
InChIKeyFDWSWNLTGFYJKN-KRWDZBQOSA-N
MW348.45 g/mol
LogP4.71
Rot. Bonds6

About (2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide

(2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide (PubChem CID 9102051) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is (2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide
PubChem CID9102051
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC Name(2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide
SMILESCc1ccc(CN(C)[C@@H](C)C(=O)Nc2ccccc2-c2ccccc2)o1
InChIInChI=1S/C22H24N2O2/c1-16-13-14-19(26-16)15-24(3)17(2)22(25)23-21-12-8-7-11-20(21)18-9-5-4-6-10-18/h4-14,17H,15H2,1-3H3,(H,23,25)/t17-/m0/s1
InChIKeyFDWSWNLTGFYJKN-KRWDZBQOSA-N
XLogP4.71
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(2-cyanophenyl)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]propanamide
CID 9102232
(2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2,3,4-trifluorophenyl)propanamide
CID 9102269
(2S)-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-phenylphenyl)propanamide
CID 9049661
(2S)-2-[methyl(2-phenoxyethyl)amino]-N-(2-phenylphenyl)propanamide
CID 8514606
N-(3-chlorophenyl)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]propanamide
CID 17436769
(2R)-N-(3-cyanophenyl)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]propanamide
CID 9102045
N-(2-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]propanamide
CID 43526612
2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-2-phenylacetic acid
CID 43526412
(2R)-N-(2,5-dimethylphenyl)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-2-phenylacetamide
CID 9103359
(2R)-N-[(4-fluorophenyl)methyl]-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]propanamide
CID 41380466
N-(3-acetylphenyl)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-2-phenylacetamide
CID 17453268
2-methylsulfanyl-N-(2-phenylphenyl)propanamide
CID 43077390

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide?
The IUPAC name of (2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide (CID 9102051) is (2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide.
What is the SMILES notation for (2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide?
The canonical SMILES for (2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide is Cc1ccc(CN(C)[C@@H](C)C(=O)Nc2ccccc2-c2ccccc2)o1.
What is the InChIKey of (2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide?
The InChIKey is FDWSWNLTGFYJKN-KRWDZBQOSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-16-13-14-19(26-16)15-24(3)17(2)22(25)23-21-12-8-7-11-20(21)18-9-5-4-6-10-18/h4-14,17H,15H2,1-3H3,(H,23,25)/t17-/m0/s1.
What are the key properties of (2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide?
(2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide has a molecular weight of 348.45 g/mol, XLogP of 4.71, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-N-(2-phenylphenyl)propanamide is sourced from PubChem (CID 9102051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).