8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline

C10H10ClN5 — CID 139080100

IUPAC8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline
SMILESCC1(C)Nc2cc(Cl)ccc2-c2nnnn21
InChIInChI=1S/C10H10ClN5/c1-10(2)12-8-5-6(11)3-4-7(8)9-13-14-15-16(9)10/h3-5,12H,1-2H3
InChIKeyCFXKWIFTFDTAIA-UHFFFAOYSA-N
MW235.68 g/mol
LogP2.11
Rot. Bonds

About 8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline

8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline (PubChem CID 139080100) has the molecular formula C10H10ClN5 and a molecular weight of 235.68 g/mol. Its IUPAC name is 8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline.

Molecular Properties

Compound Name8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline
PubChem CID139080100
Molecular FormulaC10H10ClN5
Molecular Weight235.68 g/mol
Exact Mass235.06
IUPAC Name8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline
SMILESCC1(C)Nc2cc(Cl)ccc2-c2nnnn21
InChIInChI=1S/C10H10ClN5/c1-10(2)12-8-5-6(11)3-4-7(8)9-13-14-15-16(9)10/h3-5,12H,1-2H3
InChIKeyCFXKWIFTFDTAIA-UHFFFAOYSA-N
XLogP2.11
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.68
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[5-(4-chloro-2-methoxyphenyl)tetrazol-1-yl]cyclobutane-1-carboxylic acid
CID 81155595
5-methyl-5-phenyl-6H-tetrazolo[1,5-c]quinazoline
CID 138006000
7-chloro-3-(4-chlorophenyl)-2,2-dimethyl-1H-quinazolin-4-one
CID 11209429
1-[5-(2-bromo-4-chlorophenyl)tetrazol-1-yl]cyclobutane-1-carboxylic acid
CID 107995331
(5S)-5-(4-bromophenyl)-5-methyl-6H-tetrazolo[1,5-c]quinazoline
CID 164629463
5-(4-chloro-2-nitrophenyl)-1-methyltetrazole
CID 117063952
5-(4-methoxyphenyl)-5-methyl-6H-tetrazolo[1,5-c]quinazoline
CID 138006007
5-chloro-2-[1-(2,2-dimethylpropyl)tetrazol-5-yl]aniline
CID 61376438
5-chloro-2-[1-(2-methylphenyl)tetrazol-5-yl]aniline
CID 61378359
2-[1-(2,4-dichlorophenyl)tetrazol-5-yl]-4-methylaniline
CID 65455837
5-chloro-2-[1-(3-chlorophenyl)tetrazol-5-yl]aniline
CID 61352846
5-chloro-2-[1-(2-chloro-6-methylphenyl)tetrazol-5-yl]aniline
CID 66251426

Frequently Asked Questions

What is the IUPAC name of 8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline?
The IUPAC name of 8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline (CID 139080100) is 8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline.
What is the SMILES notation for 8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline?
The canonical SMILES for 8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline is CC1(C)Nc2cc(Cl)ccc2-c2nnnn21.
What is the InChIKey of 8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline?
The InChIKey is CFXKWIFTFDTAIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN5/c1-10(2)12-8-5-6(11)3-4-7(8)9-13-14-15-16(9)10/h3-5,12H,1-2H3.
What are the key properties of 8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline?
8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline has a molecular weight of 235.68 g/mol, XLogP of 2.11, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-5,5-dimethyl-6H-tetrazolo[1,5-c]quinazoline is sourced from PubChem (CID 139080100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).