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

C13H21N3O2S — CID 66257106

IUPACN-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)NCc1nc(C)cs1
InChIInChI=1S/C13H21N3O2S/c1-3-4-14-11-7-18-6-10(11)13(17)15-5-12-16-9(2)8-19-12/h8,10-11,14H,3-7H2,1-2H3,(H,15,17)
InChIKeySUAIFEXNYLXPJZ-UHFFFAOYSA-N
MW283.40 g/mol
LogP1.08
Rot. Bonds6

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

N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide (PubChem CID 66257106) has the molecular formula C13H21N3O2S and a molecular weight of 283.40 g/mol. Its IUPAC name is N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide
PubChem CID66257106
Molecular FormulaC13H21N3O2S
Molecular Weight283.40 g/mol
Exact Mass283.14
IUPAC NameN-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)NCc1nc(C)cs1
InChIInChI=1S/C13H21N3O2S/c1-3-4-14-11-7-18-6-10(11)13(17)15-5-12-16-9(2)8-19-12/h8,10-11,14H,3-7H2,1-2H3,(H,15,17)
InChIKeySUAIFEXNYLXPJZ-UHFFFAOYSA-N
XLogP1.08
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide
CID 106371647
6-[(4-methyl-1,3-thiazol-2-yl)methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 54913406
N-[2-(carbamoylamino)ethyl]-4-(propylamino)oxolane-3-carboxamide
CID 83110182
N-[(2-methoxyphenyl)methyl]-4-(propylamino)oxolane-3-carboxamide
CID 66256873
N-(2-cyclopropylethyl)-4-(propylamino)oxolane-3-carboxamide
CID 66256756
4-chloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]oxolan-3-amine
CID 130727351
4-(propylamino)-N-(3,3,3-trifluoropropyl)oxolane-3-carboxamide
CID 66257134
N-[2-(dimethylcarbamoylamino)ethyl]-4-(propylamino)oxolane-3-carboxamide
CID 83110481
N-(2,2-dimethoxyethyl)-4-(propylamino)oxolane-3-carboxamide
CID 66255397
N-(2,2-difluoro-3-hydroxypropyl)-4-(propylamino)oxolane-3-carboxamide
CID 114154209
N-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxamide
CID 61044449
4-(methylamino)-N-(4-methyl-1,3-thiazol-2-yl)oxolane-3-carboxamide
CID 66265370

Frequently Asked Questions

What is the IUPAC name of N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide?
The IUPAC name of N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide (CID 66257106) is N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide.
What is the SMILES notation for N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide?
The canonical SMILES for N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide is CCCNC1COCC1C(=O)NCc1nc(C)cs1.
What is the InChIKey of N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide?
The InChIKey is SUAIFEXNYLXPJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2S/c1-3-4-14-11-7-18-6-10(11)13(17)15-5-12-16-9(2)8-19-12/h8,10-11,14H,3-7H2,1-2H3,(H,15,17).
What are the key properties of N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide?
N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide has a molecular weight of 283.40 g/mol, XLogP of 1.08, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methyl-1,3-thiazol-2-yl)methyl]-4-(propylamino)oxolane-3-carboxamide is sourced from PubChem (CID 66257106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).