3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide

C13H18N2O2S — CID 64892349

IUPAC3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide
SMILESNC1(C(=O)N(Cc2cccs2)C2CC2)CCOC1
InChIInChI=1S/C13H18N2O2S/c14-13(5-6-17-9-13)12(16)15(10-3-4-10)8-11-2-1-7-18-11/h1-2,7,10H,3-6,8-9,14H2
InChIKeyBJYFMPCQXQFCEL-UHFFFAOYSA-N
MW266.37 g/mol
LogP1.36
Rot. Bonds4

About 3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide

3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide (PubChem CID 64892349) has the molecular formula C13H18N2O2S and a molecular weight of 266.37 g/mol. Its IUPAC name is 3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide
PubChem CID64892349
Molecular FormulaC13H18N2O2S
Molecular Weight266.37 g/mol
Exact Mass266.11
IUPAC Name3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide
SMILESNC1(C(=O)N(Cc2cccs2)C2CC2)CCOC1
InChIInChI=1S/C13H18N2O2S/c14-13(5-6-17-9-13)12(16)15(10-3-4-10)8-11-2-1-7-18-11/h1-2,7,10H,3-6,8-9,14H2
InChIKeyBJYFMPCQXQFCEL-UHFFFAOYSA-N
XLogP1.36
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)cyclohexane-1-carboxamide
CID 54870594
3-amino-N-cyclopropyl-N-[(3-fluorophenyl)methyl]oxolane-3-carboxamide
CID 64893161
3-amino-N-cyclopropyl-N-[(4-fluorophenyl)methyl]oxolane-3-carboxamide
CID 64891551
3-amino-N-(2-thiophen-2-ylethyl)oxolane-3-carboxamide
CID 64892897
2-(1-aminocyclopentyl)-N-cyclopropyl-N-(thiophen-2-ylmethyl)acetamide
CID 64686059
1-cyano-N-cyclopropyl-N-(thiophen-2-ylmethyl)cyclobutane-1-carboxamide
CID 80599455
4-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)oxane-4-carboxamide
CID 115294700
N-(oxan-4-yl)-N-(thiophen-2-ylmethyl)adamantane-1-carboxamide
CID 90610662
3-amino-N-cyclopropyl-2,2,3-trimethyl-N-(thiophen-2-ylmethyl)butanamide
CID 65269853
N-cyclopropyl-N-(thiophen-2-ylmethyl)oxane-4-carboxamide
CID 52571989
N-(oxan-4-yl)-N-(thiophen-2-ylmethyl)acetamide
CID 90610647
4-amino-N-methyl-N-(2-thiophen-2-ylethyl)oxane-4-carboxamide
CID 113280867

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide (CID 64892349) is 3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide is NC1(C(=O)N(Cc2cccs2)C2CC2)CCOC1.
What is the InChIKey of 3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide?
The InChIKey is BJYFMPCQXQFCEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2S/c14-13(5-6-17-9-13)12(16)15(10-3-4-10)8-11-2-1-7-18-11/h1-2,7,10H,3-6,8-9,14H2.
What are the key properties of 3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide?
3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide has a molecular weight of 266.37 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-cyclopropyl-N-(thiophen-2-ylmethyl)oxolane-3-carboxamide is sourced from PubChem (CID 64892349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).