3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane

C14H27N — CID 134421945

IUPAC3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane
SMILESCCCC1CC2(CCC2C)CN1C(C)C
InChIInChI=1S/C14H27N/c1-5-6-13-9-14(8-7-12(14)4)10-15(13)11(2)3/h11-13H,5-10H2,1-4H3
InChIKeyYRLSFBRXIBVBFL-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.69
Rot. Bonds3

About 3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane

3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane (PubChem CID 134421945) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane.

Molecular Properties

Compound Name3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane
PubChem CID134421945
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane
SMILESCCCC1CC2(CCC2C)CN1C(C)C
InChIInChI=1S/C14H27N/c1-5-6-13-9-14(8-7-12(14)4)10-15(13)11(2)3/h11-13H,5-10H2,1-4H3
InChIKeyYRLSFBRXIBVBFL-UHFFFAOYSA-N
XLogP3.69
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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3-ethyl-2-propan-2-yl-2-azaspiro[4.4]nonane
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1-propan-2-yl-5-propylpyrrolidin-3-ol
CID 102568671
(6R)-6-ethyl-7-propan-2-yl-1-oxa-7-azaspiro[3.4]octane
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(3R)-7-ethyl-3-methylspiro[3.5]nonane
CID 163822270
1-[(3S)-3-methyl-6-azaspiro[3.4]octan-6-yl]ethanethiol
CID 130223482
2-methyl-1,4-di(propan-2-yl)-6-propyl-1,4-diazepane
CID 138722839
(2R,4S)-2-ethyl-1-propan-2-yl-4-propylpyrrolidine
CID 169194158
(2R)-2-methyl-5-propan-2-yl-5-azaspiro[2.5]octane
CID 118287941
1,2,2,3-tetramethyl-1-pentan-2-ylcyclopentane
CID 123500106
4-tert-butyl-1-propan-2-yl-2-propylpiperazine;ethane
CID 155690234

Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane?
The IUPAC name of 3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane (CID 134421945) is 3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane.
What is the SMILES notation for 3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane?
The canonical SMILES for 3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane is CCCC1CC2(CCC2C)CN1C(C)C.
What is the InChIKey of 3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane?
The InChIKey is YRLSFBRXIBVBFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-5-6-13-9-14(8-7-12(14)4)10-15(13)11(2)3/h11-13H,5-10H2,1-4H3.
What are the key properties of 3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane?
3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane has a molecular weight of 209.38 g/mol, XLogP of 3.69, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-propan-2-yl-7-propyl-6-azaspiro[3.4]octane is sourced from PubChem (CID 134421945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).