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

C11H17N3O2S — CID 64892402

IUPAC3-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide
SMILESCc1csc(CCNC(=O)C2(N)CCOC2)n1
InChIInChI=1S/C11H17N3O2S/c1-8-6-17-9(14-8)2-4-13-10(15)11(12)3-5-16-7-11/h6H,2-5,7,12H2,1H3,(H,13,15)
InChIKeyRYFHBSRHTUDEAU-UHFFFAOYSA-N
MW255.34 g/mol
LogP0.23
Rot. Bonds4

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

3-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide (PubChem CID 64892402) has the molecular formula C11H17N3O2S and a molecular weight of 255.34 g/mol. Its IUPAC name is 3-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide
PubChem CID64892402
Molecular FormulaC11H17N3O2S
Molecular Weight255.34 g/mol
Exact Mass255.10
IUPAC Name3-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide
SMILESCc1csc(CCNC(=O)C2(N)CCOC2)n1
InChIInChI=1S/C11H17N3O2S/c1-8-6-17-9(14-8)2-4-13-10(15)11(12)3-5-16-7-11/h6H,2-5,7,12H2,1H3,(H,13,15)
InChIKeyRYFHBSRHTUDEAU-UHFFFAOYSA-N
XLogP0.23
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(2-Ethyl-1,3-thiazol-4-yl)methyl]-4-(oxolane-3-carbonyl)-1,4-diazepane
CID 53615439
N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide
CID 75417636
N-[(S)-cyclopropyl-(4-methyl-1,3-thiazol-2-yl)methyl]-3-ethoxypropanamide
CID 97573207
4-amino-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]oxane-4-carboxamide;hydrochloride
CID 120028566
4-amino-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]oxane-4-carboxamide
CID 120028567
4-amino-N-[1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]propyl]oxane-4-carboxamide
CID 120028832
2-amino-3-methoxy-N-[1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]propyl]propanamide
CID 120991468
N-({2-[(methylthio)methyl]-1,3-thiazol-4-yl}methyl)tetrahydrofuran-3-carboxamide
CID 56741372
3-[2-(4-Methyl-1,3-thiazol-2-yl)butan-2-ylamino]-1-morpholin-4-ylpropan-1-one
CID 71868858
N-[(4-methyl-1,3-thiazol-2-yl)methyl]oxane-4-carboxamide
CID 45806542
1-(2-methoxyethyl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 51077311
N-(oxolan-3-ylmethyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
CID 51080015

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide (CID 64892402) is 3-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide is Cc1csc(CCNC(=O)C2(N)CCOC2)n1.
What is the InChIKey of 3-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide?
The InChIKey is RYFHBSRHTUDEAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2S/c1-8-6-17-9(14-8)2-4-13-10(15)11(12)3-5-16-7-11/h6H,2-5,7,12H2,1H3,(H,13,15).
What are the key properties of 3-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide?
3-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide has a molecular weight of 255.34 g/mol, XLogP of 0.23, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide is sourced from PubChem (CID 64892402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).