N-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide

C13H15N5O2 — CID 166312516

IUPACN-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide
SMILESO=C(NC(c1nn[nH]n1)C1CC1)c1occ2c1CCC2
InChIInChI=1S/C13H15N5O2/c19-13(11-9-3-1-2-8(9)6-20-11)14-10(7-4-5-7)12-15-17-18-16-12/h6-7,10H,1-5H2,(H,14,19)(H,15,16,17,18)
InChIKeyUSNVCMNQBRRVLK-UHFFFAOYSA-N
MW273.30 g/mol
LogP1.16
Rot. Bonds4

About N-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide

N-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide (PubChem CID 166312516) has the molecular formula C13H15N5O2 and a molecular weight of 273.30 g/mol. Its IUPAC name is N-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide.

Molecular Properties

Compound NameN-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide
PubChem CID166312516
Molecular FormulaC13H15N5O2
Molecular Weight273.30 g/mol
Exact Mass273.12
IUPAC NameN-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide
SMILESO=C(NC(c1nn[nH]n1)C1CC1)c1occ2c1CCC2
InChIInChI=1S/C13H15N5O2/c19-13(11-9-3-1-2-8(9)6-20-11)14-10(7-4-5-7)12-15-17-18-16-12/h6-7,10H,1-5H2,(H,14,19)(H,15,16,17,18)
InChIKeyUSNVCMNQBRRVLK-UHFFFAOYSA-N
XLogP1.16
TPSA96.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide?
The IUPAC name of N-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide (CID 166312516) is N-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide.
What is the SMILES notation for N-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide?
The canonical SMILES for N-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide is O=C(NC(c1nn[nH]n1)C1CC1)c1occ2c1CCC2.
What is the InChIKey of N-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide?
The InChIKey is USNVCMNQBRRVLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O2/c19-13(11-9-3-1-2-8(9)6-20-11)14-10(7-4-5-7)12-15-17-18-16-12/h6-7,10H,1-5H2,(H,14,19)(H,15,16,17,18).
What are the key properties of N-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide?
N-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide has a molecular weight of 273.30 g/mol, XLogP of 1.16, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide is sourced from PubChem (CID 166312516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).