2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine

C10H19N3O — CID 62846772

IUPAC2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine
SMILESCNC(C)(C)CNCc1cc(C)no1
InChIInChI=1S/C10H19N3O/c1-8-5-9(14-13-8)6-12-7-10(2,3)11-4/h5,11-12H,6-7H2,1-4H3
InChIKeyJDNHSYJQOJCWSX-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.07
Rot. Bonds5

About 2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine

2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine (PubChem CID 62846772) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine.

Molecular Properties

Compound Name2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine
PubChem CID62846772
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine
SMILESCNC(C)(C)CNCc1cc(C)no1
InChIInChI=1S/C10H19N3O/c1-8-5-9(14-13-8)6-12-7-10(2,3)11-4/h5,11-12H,6-7H2,1-4H3
InChIKeyJDNHSYJQOJCWSX-UHFFFAOYSA-N
XLogP1.07
TPSA50.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methoxy-1-(3-methyl-1,2-oxazol-5-yl)methanamine
CID 82594380
3-[(3-methyl-1,2-oxazol-5-yl)methylamino]propane-1,2-diol
CID 76926965
N'-hydroxy-2-[(3-methyl-1,2-oxazol-5-yl)methylamino]ethanimidamide
CID 77032798
N',N'-diethyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethane-1,2-diamine
CID 60719969
1-methyl-3-[(3-methyl-1,2-oxazol-5-yl)methyl]urea
CID 53017221
N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine
CID 60712181
N-[(3-methyl-1,2-oxazol-5-yl)methyl]-3-phenylprop-2-yn-1-amine
CID 62340525
1-(4-fluoro-2-methylphenyl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]methanamine
CID 62135129
1-(4-bromo-3-methylphenyl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]methanamine
CID 66473023
1,2-dimethyl-3-[(3-methyl-1,2-oxazol-5-yl)methyl]guanidine
CID 130969421
N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine
CID 130586021
N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-(trifluoromethyl)aniline
CID 62312935

Frequently Asked Questions

What is the IUPAC name of 2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine?
The IUPAC name of 2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine (CID 62846772) is 2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine.
What is the SMILES notation for 2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine?
The canonical SMILES for 2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine is CNC(C)(C)CNCc1cc(C)no1.
What is the InChIKey of 2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine?
The InChIKey is JDNHSYJQOJCWSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-8-5-9(14-13-8)6-12-7-10(2,3)11-4/h5,11-12H,6-7H2,1-4H3.
What are the key properties of 2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine?
2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine has a molecular weight of 197.28 g/mol, XLogP of 1.07, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-dimethyl-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propane-1,2-diamine is sourced from PubChem (CID 62846772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).