N-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide

C18H23N3O2 — CID 119614530

IUPACN-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide
SMILESCc1nc(CCC(=O)NC(CN)C2CC2)oc1-c1ccccc1
InChIInChI=1S/C18H23N3O2/c1-12-18(14-5-3-2-4-6-14)23-17(20-12)10-9-16(22)21-15(11-19)13-7-8-13/h2-6,13,15H,7-11,19H2,1H3,(H,21,22)
InChIKeyBVXUDICNSQNXGC-UHFFFAOYSA-N
MW313.40 g/mol
LogP2.44
Rot. Bonds7

About N-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide

N-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide (PubChem CID 119614530) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide
PubChem CID119614530
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC NameN-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide
SMILESCc1nc(CCC(=O)NC(CN)C2CC2)oc1-c1ccccc1
InChIInChI=1S/C18H23N3O2/c1-12-18(14-5-3-2-4-6-14)23-17(20-12)10-9-16(22)21-15(11-19)13-7-8-13/h2-6,13,15H,7-11,19H2,1H3,(H,21,22)
InChIKeyBVXUDICNSQNXGC-UHFFFAOYSA-N
XLogP2.44
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-amino-2-methylpropyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide;dihydrochloride
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4-[3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanoylamino]cyclohexane-1-carboxylic acid
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3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)-N-pyrrolidin-3-ylpropanamide
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1-[4-(aminomethyl)piperidin-1-yl]-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propan-1-one;dihydrochloride
CID 119423293
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CID 119613032
3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)-N-(2-methylpiperidin-3-yl)propanamide;dihydrochloride
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N-(1-amino-2,4-dimethylpentan-2-yl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide;dihydrochloride
CID 119598473
N-[(4-hydroxypyrrolidin-3-yl)methyl]-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide;dihydrochloride
CID 120944811
N-(2-amino-1-cyclopropylethyl)-2-methyl-6-phenylpyridine-3-carboxamide
CID 119615030
N-(2-amino-1-cyclopropylethyl)-4-phenylbutanamide
CID 65189008
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide;dihydrochloride
CID 119526054

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide (CID 119614530) is N-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide is Cc1nc(CCC(=O)NC(CN)C2CC2)oc1-c1ccccc1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide?
The InChIKey is BVXUDICNSQNXGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2/c1-12-18(14-5-3-2-4-6-14)23-17(20-12)10-9-16(22)21-15(11-19)13-7-8-13/h2-6,13,15H,7-11,19H2,1H3,(H,21,22).
What are the key properties of N-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide?
N-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide has a molecular weight of 313.40 g/mol, XLogP of 2.44, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-3-(4-methyl-5-phenyl-1,3-oxazol-2-yl)propanamide is sourced from PubChem (CID 119614530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).