(3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate

C14H22N2O3 — CID 71846944

IUPAC(3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate
SMILESCc1noc(C)c1COC(=O)CN1CCC(C)CC1
InChIInChI=1S/C14H22N2O3/c1-10-4-6-16(7-5-10)8-14(17)18-9-13-11(2)15-19-12(13)3/h10H,4-9H2,1-3H3
InChIKeyZHAZXXDWOUOUKZ-UHFFFAOYSA-N
MW266.34 g/mol
LogP2.07
Rot. Bonds4

About (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate

(3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate (PubChem CID 71846944) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate.

Molecular Properties

Compound Name(3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate
PubChem CID71846944
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name(3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate
SMILESCc1noc(C)c1COC(=O)CN1CCC(C)CC1
InChIInChI=1S/C14H22N2O3/c1-10-4-6-16(7-5-10)8-14(17)18-9-13-11(2)15-19-12(13)3/h10H,4-9H2,1-3H3
InChIKeyZHAZXXDWOUOUKZ-UHFFFAOYSA-N
XLogP2.07
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-(4-methylpiperidin-1-yl)ethanamine
CID 61240480
1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperidin-4-amine;hydrochloride
CID 119907958
[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-[(3R,5R)-3,5-dimethylpiperidin-1-yl]methanone
CID 35743315
1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrrolidin-3-ol
CID 56828639
(3,5-dimethyl-1,2-oxazol-4-yl)methyl 1-methylpyrazole-4-carboxylate
CID 18122654
(3,5-dimethyl-1,2-oxazol-4-yl)methyl (3S)-3-(aminomethyl)-5-methylhexanoate;hydrochloride
CID 167766432
(3,5-dimethyl-1,2-oxazol-4-yl)methyl (6S)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
CID 7872984
(3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-carbamoyl-1-oxophthalazin-2-yl)acetate
CID 31651746
3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(3-methylpiperidin-1-yl)propan-1-one
CID 78791717
N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrrolidin-3-yl]-2-morpholin-4-ylacetamide
CID 171146257
[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl] 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate
CID 2653361
1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoyl]piperidine-4-carboxamide
CID 4789023

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate?
The IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate (CID 71846944) is (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate.
What is the SMILES notation for (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate?
The canonical SMILES for (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate is Cc1noc(C)c1COC(=O)CN1CCC(C)CC1.
What is the InChIKey of (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate?
The InChIKey is ZHAZXXDWOUOUKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-10-4-6-16(7-5-10)8-14(17)18-9-13-11(2)15-19-12(13)3/h10H,4-9H2,1-3H3.
What are the key properties of (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate?
(3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate has a molecular weight of 266.34 g/mol, XLogP of 2.07, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-(4-methylpiperidin-1-yl)acetate is sourced from PubChem (CID 71846944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).