9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane

C13H24N6 — CID 107056270

IUPAC9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane
SMILESCC1CCNC2(CCCC2)CN1Cc1nnn(C)n1
InChIInChI=1S/C13H24N6/c1-11-5-8-14-13(6-3-4-7-13)10-19(11)9-12-15-17-18(2)16-12/h11,14H,3-10H2,1-2H3
InChIKeyLPQQKUNDHJWRRG-UHFFFAOYSA-N
MW264.38 g/mol
LogP0.71
Rot. Bonds2

About 9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane

9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane (PubChem CID 107056270) has the molecular formula C13H24N6 and a molecular weight of 264.38 g/mol. Its IUPAC name is 9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane.

Molecular Properties

Compound Name9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane
PubChem CID107056270
Molecular FormulaC13H24N6
Molecular Weight264.38 g/mol
Exact Mass264.21
IUPAC Name9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane
SMILESCC1CCNC2(CCCC2)CN1Cc1nnn(C)n1
InChIInChI=1S/C13H24N6/c1-11-5-8-14-13(6-3-4-7-13)10-19(11)9-12-15-17-18(2)16-12/h11,14H,3-10H2,1-2H3
InChIKeyLPQQKUNDHJWRRG-UHFFFAOYSA-N
XLogP0.71
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.38
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-ethyl-3,7-dimethyl-1-[(2-methyltetrazol-5-yl)methyl]-1,4-diazepane
CID 107056288
8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane
CID 107055892
9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane
CID 107055328
10-methyl-11-propyl-7,11-diazaspiro[5.6]dodecane
CID 64870179
10-methyl-11-(2,2,2-trifluoroethyl)-7,11-diazaspiro[5.6]dodecane
CID 64871366
10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane
CID 81113015
10-methyl-11-(pyridin-3-ylmethyl)-7,11-diazaspiro[5.6]dodecane
CID 64872357
10-(2-ethylsulfonylethyl)-9-methyl-6,10-diazaspiro[4.6]undecane
CID 106733398
9-methyl-10-[2-(1-methylimidazol-2-yl)ethyl]-6,10-diazaspiro[4.6]undecane
CID 114532434
9-methyl-10-(3-methylbut-2-enyl)-6,10-diazaspiro[4.6]undecane
CID 114014155
11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane
CID 64871559
10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane
CID 65178467

Frequently Asked Questions

What is the IUPAC name of 9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane?
The IUPAC name of 9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane (CID 107056270) is 9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane.
What is the SMILES notation for 9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane?
The canonical SMILES for 9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane is CC1CCNC2(CCCC2)CN1Cc1nnn(C)n1.
What is the InChIKey of 9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane?
The InChIKey is LPQQKUNDHJWRRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N6/c1-11-5-8-14-13(6-3-4-7-13)10-19(11)9-12-15-17-18(2)16-12/h11,14H,3-10H2,1-2H3.
What are the key properties of 9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane?
9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane has a molecular weight of 264.38 g/mol, XLogP of 0.71, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-10-[(2-methyltetrazol-5-yl)methyl]-6,10-diazaspiro[4.6]undecane is sourced from PubChem (CID 107056270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).