4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide

C11H17N3O2S — CID 114130919

IUPAC4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide
SMILESCC(C)(NC(=O)C1COCC1N)c1nccs1
InChIInChI=1S/C11H17N3O2S/c1-11(2,10-13-3-4-17-10)14-9(15)7-5-16-6-8(7)12/h3-4,7-8H,5-6,12H2,1-2H3,(H,14,15)
InChIKeyRTCMPMZWWWPQSW-UHFFFAOYSA-N
MW255.34 g/mol
LogP0.47
Rot. Bonds3

About 4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide

4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide (PubChem CID 114130919) has the molecular formula C11H17N3O2S and a molecular weight of 255.34 g/mol. Its IUPAC name is 4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide
PubChem CID114130919
Molecular FormulaC11H17N3O2S
Molecular Weight255.34 g/mol
Exact Mass255.10
IUPAC Name4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide
SMILESCC(C)(NC(=O)C1COCC1N)c1nccs1
InChIInChI=1S/C11H17N3O2S/c1-11(2,10-13-3-4-17-10)14-9(15)7-5-16-6-8(7)12/h3-4,7-8H,5-6,12H2,1-2H3,(H,14,15)
InChIKeyRTCMPMZWWWPQSW-UHFFFAOYSA-N
XLogP0.47
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(1,3-thiazol-2-yl)propan-2-yl]prop-2-ynamide
CID 130748525
4-amino-N-[2-(1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide
CID 66237908
4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxane-4-carboxamide
CID 103845803
N-[2-(1,3-thiazol-2-yl)propan-2-yl]piperidine-3-carboxamide
CID 110471917
1-acetyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyrrolidine-3-carboxamide
CID 136512712
(3R,4S)-4-(1-methylpyrazol-4-yl)-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyrrolidine-3-carboxamide
CID 120939712
N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-2-carboxamide
CID 110470912
1-ethyl-3-[2-(1,3-thiazol-2-yl)propan-2-yl]urea
CID 103672241
(2R)-2-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]butanamide
CID 104878243
2-bromo-N-[2-(1,3-thiazol-2-yl)propan-2-yl]furan-3-carboxamide
CID 107091806
3-amino-4,4-dimethyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pentanamide
CID 114130929
N-ethyl-4-[[2-(1,3-thiazol-2-yl)propan-2-ylamino]methyl]oxolan-3-amine
CID 114132035

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide?
The IUPAC name of 4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide (CID 114130919) is 4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide is CC(C)(NC(=O)C1COCC1N)c1nccs1.
What is the InChIKey of 4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide?
The InChIKey is RTCMPMZWWWPQSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2S/c1-11(2,10-13-3-4-17-10)14-9(15)7-5-16-6-8(7)12/h3-4,7-8H,5-6,12H2,1-2H3,(H,14,15).
What are the key properties of 4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide?
4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide has a molecular weight of 255.34 g/mol, XLogP of 0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(1,3-thiazol-2-yl)propan-2-yl]oxolane-3-carboxamide is sourced from PubChem (CID 114130919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).