2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide

C19H24N2O4 — CID 94488168

IUPAC2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide
SMILESCc1occc1C(=O)NCC(=O)N[C@@H](C)c1cccc(OC(C)C)c1
InChIInChI=1S/C19H24N2O4/c1-12(2)25-16-7-5-6-15(10-16)13(3)21-18(22)11-20-19(23)17-8-9-24-14(17)4/h5-10,12-13H,11H2,1-4H3,(H,20,23)(H,21,22)/t13-/m0/s1
InChIKeyBRNKOTVPOMQQPM-ZDUSSCGKSA-N
MW344.41 g/mol
LogP2.98
Rot. Bonds7

About 2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide

2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide (PubChem CID 94488168) has the molecular formula C19H24N2O4 and a molecular weight of 344.41 g/mol. Its IUPAC name is 2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide
PubChem CID94488168
Molecular FormulaC19H24N2O4
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC Name2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide
SMILESCc1occc1C(=O)NCC(=O)N[C@@H](C)c1cccc(OC(C)C)c1
InChIInChI=1S/C19H24N2O4/c1-12(2)25-16-7-5-6-15(10-16)13(3)21-18(22)11-20-19(23)17-8-9-24-14(17)4/h5-10,12-13H,11H2,1-4H3,(H,20,23)(H,21,22)/t13-/m0/s1
InChIKeyBRNKOTVPOMQQPM-ZDUSSCGKSA-N
XLogP2.98
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide with MolForge

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Related Compounds

N-[2-hydroxy-2-(3-propan-2-yloxyphenyl)ethyl]-2-methylfuran-3-carboxamide
CID 111423746
N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-methylfuran-3-carboxamide
CID 42961734
2-chloro-N-[1-(3-propan-2-yloxyphenyl)ethyl]furan-3-carboxamide
CID 106685966
2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide
CID 43705705
3-(propan-2-ylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]propanamide
CID 60852899
4-chloro-N-[1-(3-propan-2-yloxyphenyl)ethyl]butanamide
CID 63307817
2-methyl-N-[2-[[(1S)-2-methyl-1-(2-methylphenyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide
CID 95631821
2-methyl-N-[3-[1-(methylamino)ethyl]phenyl]furan-3-carboxamide
CID 43507800
4-(5-methylthiophen-2-yl)-4-oxo-N-[1-(3-propan-2-yloxyphenyl)ethyl]butanamide
CID 55713603
1-[2-(furan-2-yl)-2-hydroxyethyl]-3-[1-(3-propan-2-yloxyphenyl)ethyl]urea
CID 110893573
N-(furan-2-ylmethyl)-2-[1-(3-propan-2-yloxyphenyl)ethylamino]acetamide
CID 146125544
2-acetamido-N-[1-(3-ethoxyphenyl)ethyl]acetamide
CID 75418201

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide?
The IUPAC name of 2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide (CID 94488168) is 2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide?
The canonical SMILES for 2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide is Cc1occc1C(=O)NCC(=O)N[C@@H](C)c1cccc(OC(C)C)c1.
What is the InChIKey of 2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide?
The InChIKey is BRNKOTVPOMQQPM-ZDUSSCGKSA-N. The full InChI is InChI=1S/C19H24N2O4/c1-12(2)25-16-7-5-6-15(10-16)13(3)21-18(22)11-20-19(23)17-8-9-24-14(17)4/h5-10,12-13H,11H2,1-4H3,(H,20,23)(H,21,22)/t13-/m0/s1.
What are the key properties of 2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide?
2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide has a molecular weight of 344.41 g/mol, XLogP of 2.98, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-oxo-2-[[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]amino]ethyl]furan-3-carboxamide is sourced from PubChem (CID 94488168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).