2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine

C10H16N2O2 — CID 115336384

IUPAC2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine
SMILESCc1cc(CNC2CCOC2C)no1
InChIInChI=1S/C10H16N2O2/c1-7-5-9(12-14-7)6-11-10-3-4-13-8(10)2/h5,8,10-11H,3-4,6H2,1-2H3
InChIKeyDDQAWIGTVLULGG-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.25
Rot. Bonds3

About 2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine

2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine (PubChem CID 115336384) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine.

Molecular Properties

Compound Name2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine
PubChem CID115336384
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine
SMILESCc1cc(CNC2CCOC2C)no1
InChIInChI=1S/C10H16N2O2/c1-7-5-9(12-14-7)6-11-10-3-4-13-8(10)2/h5,8,10-11H,3-4,6H2,1-2H3
InChIKeyDDQAWIGTVLULGG-UHFFFAOYSA-N
XLogP1.25
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopentan-1-amine
CID 65045485
2-methyl-N-[(2,4,5-trimethylphenyl)methyl]oxolan-3-amine
CID 82726551
2-[(5-methyl-1,2-oxazol-3-yl)methylamino]cycloheptane-1-carbonitrile
CID 62742459
N-[(4-ethylphenyl)methyl]-2-methyloxolan-3-amine
CID 115337185
1-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-amine
CID 60694528
2-[(5-methyl-1,2-oxazol-3-yl)methylamino]cycloheptane-1-carboxamide
CID 86802324
(2R,3R)-N-[(4-chlorophenyl)methyl]-2-methyloxolan-3-amine
CID 97358120
1-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclobutane-1,3-diamine
CID 80560659
(2R,3R)-2-methyl-N-[(5-methyl-1,3-oxazol-4-yl)methyl]oxolan-3-amine
CID 131107703
2-methyl-N-(1H-1,2,4-triazol-5-ylmethyl)oxolan-3-amine
CID 82727643
(2R,3R)-2-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]oxolan-3-amine
CID 131031494
(2R,3R)-2-methyl-N-(1,3-thiazol-5-ylmethyl)oxolan-3-amine
CID 130933670

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine?
The IUPAC name of 2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine (CID 115336384) is 2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine.
What is the SMILES notation for 2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine?
The canonical SMILES for 2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine is Cc1cc(CNC2CCOC2C)no1.
What is the InChIKey of 2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine?
The InChIKey is DDQAWIGTVLULGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-7-5-9(12-14-7)6-11-10-3-4-13-8(10)2/h5,8,10-11H,3-4,6H2,1-2H3.
What are the key properties of 2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine?
2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine has a molecular weight of 196.25 g/mol, XLogP of 1.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine is sourced from PubChem (CID 115336384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).