[3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone

C19H29N3O3 — CID 110234801

IUPAC[3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone
SMILESO=C(N1CCCCC1)C1(Cc2cc(C3CCOC3)no2)CCCNC1
InChIInChI=1S/C19H29N3O3/c23-18(22-8-2-1-3-9-22)19(6-4-7-20-14-19)12-16-11-17(21-25-16)15-5-10-24-13-15/h11,15,20H,1-10,12-14H2
InChIKeyMTZDLLBKVWTPPJ-UHFFFAOYSA-N
MW347.46 g/mol
LogP2.10
Rot. Bonds4

About [3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone

[3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone (PubChem CID 110234801) has the molecular formula C19H29N3O3 and a molecular weight of 347.46 g/mol. Its IUPAC name is [3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone
PubChem CID110234801
Molecular FormulaC19H29N3O3
Molecular Weight347.46 g/mol
Exact Mass347.22
IUPAC Name[3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone
SMILESO=C(N1CCCCC1)C1(Cc2cc(C3CCOC3)no2)CCCNC1
InChIInChI=1S/C19H29N3O3/c23-18(22-8-2-1-3-9-22)19(6-4-7-20-14-19)12-16-11-17(21-25-16)15-5-10-24-13-15/h11,15,20H,1-10,12-14H2
InChIKeyMTZDLLBKVWTPPJ-UHFFFAOYSA-N
XLogP2.10
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]-N-prop-2-ynylpiperidine-3-carboxamide
CID 110234794
N-[(2S)-1-methoxypropan-2-yl]-4-[[3-[(3R)-oxolan-3-yl]-1,2-oxazol-5-yl]methyl]piperidine-4-carboxamide
CID 92582042
N-[(2R)-1-methoxypropan-2-yl]-4-[[3-[(3S)-oxolan-3-yl]-1,2-oxazol-5-yl]methyl]piperidine-4-carboxamide
CID 92582039
N-(1-methoxypropan-2-yl)-4-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidine-4-carboxamide;hydrochloride
CID 175652751
[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methanol
CID 45099358
azocan-1-yl-(3-ethylpiperidin-3-yl)methanone
CID 55179345
5-(3-methylpiperidin-3-yl)-3-(oxolan-3-yl)-1,2,4-oxadiazole
CID 65330606
N,N-dimethyl-3-[[3-(4-methylphenyl)sulfonyl-1,2-oxazol-5-yl]methyl]piperidine-3-carboxamide;hydrochloride
CID 154729802
1-[3-[(3-phenyl-1,2-oxazol-5-yl)methyl]-3-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]ethanone
CID 110129866
(4-hydroxypiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone
CID 63132180
1-[2-methyl-6-[(3R)-oxolan-3-yl]pyrimidin-4-yl]-4-piperidin-1-ylpiperidine-4-carboxamide
CID 126446357
ethyl 1-(3-ethylpiperidine-3-carbonyl)piperidine-3-carboxylate
CID 63132317

Frequently Asked Questions

What is the IUPAC name of [3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone?
The IUPAC name of [3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone (CID 110234801) is [3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone.
What is the SMILES notation for [3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone?
The canonical SMILES for [3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone is O=C(N1CCCCC1)C1(Cc2cc(C3CCOC3)no2)CCCNC1.
What is the InChIKey of [3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone?
The InChIKey is MTZDLLBKVWTPPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O3/c23-18(22-8-2-1-3-9-22)19(6-4-7-20-14-19)12-16-11-17(21-25-16)15-5-10-24-13-15/h11,15,20H,1-10,12-14H2.
What are the key properties of [3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone?
[3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone has a molecular weight of 347.46 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[3-(oxolan-3-yl)-1,2-oxazol-5-yl]methyl]piperidin-3-yl]-piperidin-1-ylmethanone is sourced from PubChem (CID 110234801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).