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

C19H23N3O2 — CID 167148891

IUPAC2-amino-3,3-dicyclopropyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]propanamide
SMILESCc1ncoc1-c1ccc(NC(=O)C(N)C(C2CC2)C2CC2)cc1
InChIInChI=1S/C19H23N3O2/c1-11-18(24-10-21-11)14-6-8-15(9-7-14)22-19(23)17(20)16(12-2-3-12)13-4-5-13/h6-10,12-13,16-17H,2-5,20H2,1H3,(H,22,23)
InChIKeyFOIXYKPZUBHNAM-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.35
Rot. Bonds6

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

2-amino-3,3-dicyclopropyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]propanamide (PubChem CID 167148891) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 2-amino-3,3-dicyclopropyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]propanamide.

Molecular Properties

Compound Name2-amino-3,3-dicyclopropyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]propanamide
PubChem CID167148891
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name2-amino-3,3-dicyclopropyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]propanamide
SMILESCc1ncoc1-c1ccc(NC(=O)C(N)C(C2CC2)C2CC2)cc1
InChIInChI=1S/C19H23N3O2/c1-11-18(24-10-21-11)14-6-8-15(9-7-14)22-19(23)17(20)16(12-2-3-12)13-4-5-13/h6-10,12-13,16-17H,2-5,20H2,1H3,(H,22,23)
InChIKeyFOIXYKPZUBHNAM-UHFFFAOYSA-N
XLogP3.35
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-3,3-dicyclopropyl-N-[4-(3,5-dimethylimidazol-4-yl)phenyl]propanamide
CID 154953624
2-amino-3,3-dicyclopropyl-N-(4-iodophenyl)propanamide
CID 154944123
(2S)-2-amino-3,3-dicyclopropyl-N-(4-iodophenyl)propanamide
CID 149303159
(2R,6S)-2,6-dimethyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]oxan-4-amine
CID 154771031
(2S)-2-amino-2-cyclopentyl-N-[4-(2,4-dimethyl-3-pyridinyl)phenyl]acetamide
CID 175462730
[1,1-dicyclopropyl-3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)anilino]-3-oxopropan-2-yl]carbamic acid
CID 154944157
1-formyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenoxy]pyrrolidine-2-carboxamide
CID 142573115
(2S)-N-[(1R)-1-[[(2R)-2-acetamido-2-cyclopropylacetyl]amino]-2,3-dihydro-1H-inden-5-yl]-2-amino-3,3-dicyclopropylpropanamide
CID 177368511
2-amino-N-[4-(1,2,4-oxadiazol-3-yl)phenyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120790973
(2S)-2-amino-2-cyclohexyl-N-[4-(3,5-dimethyl-4-pyridinyl)phenyl]acetamide
CID 163275805
3,3-dicyclopropyl-N-[4-(3,5-dimethyl-1H-pyrazol-4-yl)phenyl]-2-(1H-imidazol-2-yl)propanamide
CID 166903535
5-(4-ethylphenyl)-4-methyl-1,3-oxazole
CID 82125408

Frequently Asked Questions

What is the IUPAC name of 2-amino-3,3-dicyclopropyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]propanamide?
The IUPAC name of 2-amino-3,3-dicyclopropyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]propanamide (CID 167148891) is 2-amino-3,3-dicyclopropyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]propanamide.
What is the SMILES notation for 2-amino-3,3-dicyclopropyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]propanamide?
The canonical SMILES for 2-amino-3,3-dicyclopropyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]propanamide is Cc1ncoc1-c1ccc(NC(=O)C(N)C(C2CC2)C2CC2)cc1.
What is the InChIKey of 2-amino-3,3-dicyclopropyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]propanamide?
The InChIKey is FOIXYKPZUBHNAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-11-18(24-10-21-11)14-6-8-15(9-7-14)22-19(23)17(20)16(12-2-3-12)13-4-5-13/h6-10,12-13,16-17H,2-5,20H2,1H3,(H,22,23).
What are the key properties of 2-amino-3,3-dicyclopropyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]propanamide?
2-amino-3,3-dicyclopropyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]propanamide has a molecular weight of 325.41 g/mol, XLogP of 3.35, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3,3-dicyclopropyl-N-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]propanamide is sourced from PubChem (CID 167148891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).