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

C9H15N3O2 — CID 43588860

IUPAC3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide
SMILESCc1cc(CN(C)C(=O)CCN)no1
InChIInChI=1S/C9H15N3O2/c1-7-5-8(11-14-7)6-12(2)9(13)3-4-10/h5H,3-4,6,10H2,1-2H3
InChIKeyQDVLORQJCFAYTF-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.29
Rot. Bonds4

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

3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide (PubChem CID 43588860) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide.

Molecular Properties

Compound Name3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide
PubChem CID43588860
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide
SMILESCc1cc(CN(C)C(=O)CCN)no1
InChIInChI=1S/C9H15N3O2/c1-7-5-8(11-14-7)6-12(2)9(13)3-4-10/h5H,3-4,6,10H2,1-2H3
InChIKeyQDVLORQJCFAYTF-UHFFFAOYSA-N
XLogP0.29
TPSA72.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-4-oxo-4-phenylbutanamide
CID 86979897
3-cyclopentyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide
CID 51077919
N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-(2-methylpropoxy)propanamide
CID 86985859
3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-phenylpropanamide
CID 43588867
N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-(2-oxo-1-pyridinyl)propanamide
CID 86984764
2-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide
CID 43588863
2-anilino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]acetamide;hydrochloride
CID 119729314
2-[2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]-2-oxoethyl]benzoic acid
CID 115923697
2-(4-chlorophenoxy)-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]acetamide
CID 110714502
3-amino-N,2,2,3-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]butanamide
CID 65264344
1-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclobutane-1-carboxamide
CID 81178859
2-(3-fluorophenyl)-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]acetamide
CID 110714525

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide?
The IUPAC name of 3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide (CID 43588860) is 3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide.
What is the SMILES notation for 3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide?
The canonical SMILES for 3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide is Cc1cc(CN(C)C(=O)CCN)no1.
What is the InChIKey of 3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide?
The InChIKey is QDVLORQJCFAYTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-7-5-8(11-14-7)6-12(2)9(13)3-4-10/h5H,3-4,6,10H2,1-2H3.
What are the key properties of 3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide?
3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide has a molecular weight of 197.24 g/mol, XLogP of 0.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide is sourced from PubChem (CID 43588860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).