4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol

C14H23NO — CID 123981427

IUPAC4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol
SMILESCC=CC1=C(C)C2(CCN(C)CC2)C(O)C1
InChIInChI=1S/C14H23NO/c1-4-5-12-10-13(16)14(11(12)2)6-8-15(3)9-7-14/h4-5,13,16H,6-10H2,1-3H3
InChIKeyCBDHYFYVQFIXJX-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.36
Rot. Bonds1

About 4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol

4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol (PubChem CID 123981427) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol.

Molecular Properties

Compound Name4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol
PubChem CID123981427
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol
SMILESCC=CC1=C(C)C2(CCN(C)CC2)C(O)C1
InChIInChI=1S/C14H23NO/c1-4-5-12-10-13(16)14(11(12)2)6-8-15(3)9-7-14/h4-5,13,16H,6-10H2,1-3H3
InChIKeyCBDHYFYVQFIXJX-UHFFFAOYSA-N
XLogP2.36
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol?
The IUPAC name of 4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol (CID 123981427) is 4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol.
What is the SMILES notation for 4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol?
The canonical SMILES for 4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol is CC=CC1=C(C)C2(CCN(C)CC2)C(O)C1.
What is the InChIKey of 4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol?
The InChIKey is CBDHYFYVQFIXJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-4-5-12-10-13(16)14(11(12)2)6-8-15(3)9-7-14/h4-5,13,16H,6-10H2,1-3H3.
What are the key properties of 4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol?
4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol has a molecular weight of 221.34 g/mol, XLogP of 2.36, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,8-dimethyl-3-prop-1-enyl-8-azaspiro[4.5]dec-3-en-1-ol is sourced from PubChem (CID 123981427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).