N-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide

C10H17N3O2 — CID 110834106

IUPACN-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide
SMILESCc1nocc1CCC(=O)NC(C)CN
InChIInChI=1S/C10H17N3O2/c1-7(5-11)12-10(14)4-3-9-6-15-13-8(9)2/h6-7H,3-5,11H2,1-2H3,(H,12,14)
InChIKeyPAKOWIBBDPCNBO-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.38
Rot. Bonds5

About N-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide

N-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide (PubChem CID 110834106) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide.

Molecular Properties

Compound NameN-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide
PubChem CID110834106
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC NameN-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide
SMILESCc1nocc1CCC(=O)NC(C)CN
InChIInChI=1S/C10H17N3O2/c1-7(5-11)12-10(14)4-3-9-6-15-13-8(9)2/h6-7H,3-5,11H2,1-2H3,(H,12,14)
InChIKeyPAKOWIBBDPCNBO-UHFFFAOYSA-N
XLogP0.38
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-[3-(3-methyl-1,2-oxazol-4-yl)propanoylamino]propanoic acid
CID 110837052
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N-[(2S)-1-aminopropan-2-yl]-3-(2,4-dimethylphenyl)propanamide;hydrochloride
CID 120507266
N-(1-aminopropan-2-yl)-3-(2-fluorophenyl)propanamide
CID 110833187
N-(1-aminopropan-2-yl)-3-(2-chlorophenyl)propanamide
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N-[(2S)-1-aminopropan-2-yl]-3-thiophen-2-ylpropanamide
CID 120509228
N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide
CID 110833199
N-(3-aminopropyl)-2-(3-methyl-1,2-oxazol-4-yl)acetamide
CID 83617752
N-[(2S)-1-aminopropan-2-yl]-3-thiophen-3-ylpropanamide
CID 120507235
N-(1-aminopropan-2-yl)-2-(5-methyl-1,3-oxazol-2-yl)acetamide
CID 83617650
(3-methyl-1,2-oxazol-4-yl)methanamine;hydrochloride
CID 71306254
N-[(2S)-1-aminopropan-2-yl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide;dihydrochloride
CID 120505530

Frequently Asked Questions

What is the IUPAC name of N-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide?
The IUPAC name of N-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide (CID 110834106) is N-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide.
What is the SMILES notation for N-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide?
The canonical SMILES for N-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide is Cc1nocc1CCC(=O)NC(C)CN.
What is the InChIKey of N-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide?
The InChIKey is PAKOWIBBDPCNBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-7(5-11)12-10(14)4-3-9-6-15-13-8(9)2/h6-7H,3-5,11H2,1-2H3,(H,12,14).
What are the key properties of N-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide?
N-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide has a molecular weight of 211.26 g/mol, XLogP of 0.38, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopropan-2-yl)-3-(3-methyl-1,2-oxazol-4-yl)propanamide is sourced from PubChem (CID 110834106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).