[4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone

C16H25N3O3 — CID 53146798

IUPAC[4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone
SMILESCC(C)c1c(C2CCN(C(=O)C3CCCO3)CC2)noc1N
InChIInChI=1S/C16H25N3O3/c1-10(2)13-14(18-22-15(13)17)11-5-7-19(8-6-11)16(20)12-4-3-9-21-12/h10-12H,3-9,17H2,1-2H3
InChIKeyNDMQNXMAVANKDV-UHFFFAOYSA-N
MW307.39 g/mol
LogP2.27
Rot. Bonds3

About [4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone

[4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone (PubChem CID 53146798) has the molecular formula C16H25N3O3 and a molecular weight of 307.39 g/mol. Its IUPAC name is [4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone.

Molecular Properties

Compound Name[4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone
PubChem CID53146798
Molecular FormulaC16H25N3O3
Molecular Weight307.39 g/mol
Exact Mass307.19
IUPAC Name[4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone
SMILESCC(C)c1c(C2CCN(C(=O)C3CCCO3)CC2)noc1N
InChIInChI=1S/C16H25N3O3/c1-10(2)13-14(18-22-15(13)17)11-5-7-19(8-6-11)16(20)12-4-3-9-21-12/h10-12H,3-9,17H2,1-2H3
InChIKeyNDMQNXMAVANKDV-UHFFFAOYSA-N
XLogP2.27
TPSA81.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone with MolForge

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Related Compounds

[4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(3,4-difluorophenyl)methanone
CID 53146783
[4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(2-chloro-5-methylsulfanylphenyl)methanone
CID 53146772
[(2S)-oxolan-2-yl]-[(4S)-4-propan-2-ylazepan-1-yl]methanone
CID 95627899
[4-[(1R)-1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]piperazin-1-yl]-[(2S)-oxolan-2-yl]methanone
CID 94032209
ethane;1-[4-(oxolane-2-carbonyl)piperazin-1-yl]ethanone
CID 143678083
[4-(1-aminopropan-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 55202925
[4-(1-bromoethyl)piperidin-1-yl]-(oxan-2-yl)methanone
CID 106839160
[(3R)-3-methylpyrrolidin-1-yl]-[(2R)-oxolan-2-yl]methanone
CID 143794584
1-[4-[1-(oxolane-2-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]ethanone
CID 113003827
(4-amino-3-methylpiperidin-1-yl)-(oxolan-2-yl)methanone;hydrochloride
CID 119260927
[4-(3-amino-2-methylpropyl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 43251966
4-(5-amino-4-methyl-1,2-oxazol-3-yl)-N-cyclopentylpiperidine-1-carboxamide
CID 53146814

Frequently Asked Questions

What is the IUPAC name of [4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone?
The IUPAC name of [4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone (CID 53146798) is [4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone.
What is the SMILES notation for [4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone?
The canonical SMILES for [4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone is CC(C)c1c(C2CCN(C(=O)C3CCCO3)CC2)noc1N.
What is the InChIKey of [4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone?
The InChIKey is NDMQNXMAVANKDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O3/c1-10(2)13-14(18-22-15(13)17)11-5-7-19(8-6-11)16(20)12-4-3-9-21-12/h10-12H,3-9,17H2,1-2H3.
What are the key properties of [4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone?
[4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone has a molecular weight of 307.39 g/mol, XLogP of 2.27, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(5-amino-4-propan-2-yl-1,2-oxazol-3-yl)piperidin-1-yl]-(oxolan-2-yl)methanone is sourced from PubChem (CID 53146798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).