1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide

C10H14FN5O — CID 166312475

IUPAC1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide
SMILESO=C(NC1(c2nn[nH]n2)CCC1)C1(F)CCC1
InChIInChI=1S/C10H14FN5O/c11-9(3-1-4-9)8(17)12-10(5-2-6-10)7-13-15-16-14-7/h1-6H2,(H,12,17)(H,13,14,15,16)
InChIKeyHICWVMVBQWJKIY-UHFFFAOYSA-N
MW239.25 g/mol
LogP0.59
Rot. Bonds3

About 1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide

1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide (PubChem CID 166312475) has the molecular formula C10H14FN5O and a molecular weight of 239.25 g/mol. Its IUPAC name is 1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide
PubChem CID166312475
Molecular FormulaC10H14FN5O
Molecular Weight239.25 g/mol
Exact Mass239.12
IUPAC Name1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide
SMILESO=C(NC1(c2nn[nH]n2)CCC1)C1(F)CCC1
InChIInChI=1S/C10H14FN5O/c11-9(3-1-4-9)8(17)12-10(5-2-6-10)7-13-15-16-14-7/h1-6H2,(H,12,17)(H,13,14,15,16)
InChIKeyHICWVMVBQWJKIY-UHFFFAOYSA-N
XLogP0.59
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.25
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-hydroxy-N-[1-(2H-tetrazol-5-yl)cyclopropyl]acetamide
CID 130723767
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4-tert-butyl-N-[1-(2H-tetrazol-5-yl)cyclobutyl]piperidine-1-carboxamide
CID 118688724
3-propan-2-yl-N-[1-(2H-tetrazol-5-yl)cyclobutyl]furan-2-carboxamide
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N-[1-(2H-tetrazol-5-yl)cyclopentyl]-6,7-dihydro-5H-pyrrolizine-2-carboxamide
CID 166303306
4-(3-chlorophenyl)-N-[1-(2H-tetrazol-5-yl)cyclopropyl]oxane-4-carboxamide
CID 86806373
1-(5-cyclopropyl-1-propylpyrazol-4-yl)-3-[1-(2H-tetrazol-5-yl)cyclobutyl]urea
CID 139017703
2-cyano-N-[4-(2H-tetrazol-5-yl)oxan-4-yl]propanamide
CID 167982011
1-(2H-tetrazol-5-yl)cyclopentan-1-amine
CID 54594012
1-(2H-tetrazol-5-yl)cyclohexan-1-amine
CID 61149474
1-(2H-tetrazol-5-yl)cyclooctan-1-amine
CID 61150852
N-quinolin-4-yl-1-(2H-tetrazol-5-yl)cyclobutane-1-carboxamide
CID 167832169

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide?
The IUPAC name of 1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide (CID 166312475) is 1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide.
What is the SMILES notation for 1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide?
The canonical SMILES for 1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide is O=C(NC1(c2nn[nH]n2)CCC1)C1(F)CCC1.
What is the InChIKey of 1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide?
The InChIKey is HICWVMVBQWJKIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN5O/c11-9(3-1-4-9)8(17)12-10(5-2-6-10)7-13-15-16-14-7/h1-6H2,(H,12,17)(H,13,14,15,16).
What are the key properties of 1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide?
1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide has a molecular weight of 239.25 g/mol, XLogP of 0.59, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-N-[1-(2H-tetrazol-5-yl)cyclobutyl]cyclobutane-1-carboxamide is sourced from PubChem (CID 166312475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).