5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine

C9H15N3O — CID 112709490

IUPAC5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine
SMILESCc1cnc(NCC2CCNC2)o1
InChIInChI=1S/C9H15N3O/c1-7-4-11-9(13-7)12-6-8-2-3-10-5-8/h4,8,10H,2-3,5-6H2,1H3,(H,11,12)
InChIKeyADVHQLJVOLOCPE-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.00
Rot. Bonds3

About 5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine

5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine (PubChem CID 112709490) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine.

Molecular Properties

Compound Name5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine
PubChem CID112709490
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine
SMILESCc1cnc(NCC2CCNC2)o1
InChIInChI=1S/C9H15N3O/c1-7-4-11-9(13-7)12-6-8-2-3-10-5-8/h4,8,10H,2-3,5-6H2,1H3,(H,11,12)
InChIKeyADVHQLJVOLOCPE-UHFFFAOYSA-N
XLogP1.00
TPSA50.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-3,3-difluoro-2-methyl-N-(5-methyl-1,3-oxazol-2-yl)butanamide
CID 164637263
(5-Methyl-1,3-oxazol-2-yl)cyanamide
CID 119091426
1-(2-Fluoroethyl)-3-(5-methyl-1,3-oxazol-2-yl)urea
CID 130678704
3,3-difluoro-2-methyl-N-(5-methyl-1,3-oxazol-2-yl)butanamide
CID 132299785
2-[(3R)-3-fluoropyrrolidin-1-yl]-5-propan-2-yl-1,3-oxazole
CID 137929270
2-Isobutyramido-5-methyloxazole
CID 12556853
N,5-Dimethyloxazol-2-amine
CID 18683475
N-(5-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide
CID 21323623
N-(4-methylpentyl)-5-propan-2-yl-1,3-oxazol-2-amine
CID 22891614
N-(5-methyl-1,3-oxazol-2-yl)acetamide
CID 58459820
3-[(5-Methyl-1,3-oxazol-2-yl)amino]butan-2-one
CID 59493413
N-cyclopropyl-5-methyl-1,3-oxazol-2-amine
CID 67382310

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine?
The IUPAC name of 5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine (CID 112709490) is 5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine.
What is the SMILES notation for 5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine?
The canonical SMILES for 5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine is Cc1cnc(NCC2CCNC2)o1.
What is the InChIKey of 5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine?
The InChIKey is ADVHQLJVOLOCPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-7-4-11-9(13-7)12-6-8-2-3-10-5-8/h4,8,10H,2-3,5-6H2,1H3,(H,11,12).
What are the key properties of 5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine?
5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine has a molecular weight of 181.24 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine is sourced from PubChem (CID 112709490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).