(3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol

C9H15NO — CID 174024874

IUPAC(3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol
SMILESCC1C/C=C(N)\C=C/CC1O
InChIInChI=1S/C9H15NO/c1-7-5-6-8(10)3-2-4-9(7)11/h2-3,6-7,9,11H,4-5,10H2,1H3/b3-2-,8-6+
InChIKeyKYSLFHHKDUTKAN-LGVURTOVSA-N
MW153.22 g/mol
LogP1.18
Rot. Bonds

About (3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol

(3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol (PubChem CID 174024874) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is (3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol.

Molecular Properties

Compound Name(3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol
PubChem CID174024874
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name(3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol
SMILESCC1C/C=C(N)\C=C/CC1O
InChIInChI=1S/C9H15NO/c1-7-5-6-8(10)3-2-4-9(7)11/h2-3,6-7,9,11H,4-5,10H2,1H3/b3-2-,8-6+
InChIKeyKYSLFHHKDUTKAN-LGVURTOVSA-N
XLogP1.18
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol?
The IUPAC name of (3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol (CID 174024874) is (3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol.
What is the SMILES notation for (3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol?
The canonical SMILES for (3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol is CC1C/C=C(N)\C=C/CC1O.
What is the InChIKey of (3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol?
The InChIKey is KYSLFHHKDUTKAN-LGVURTOVSA-N. The full InChI is InChI=1S/C9H15NO/c1-7-5-6-8(10)3-2-4-9(7)11/h2-3,6-7,9,11H,4-5,10H2,1H3/b3-2-,8-6+.
What are the key properties of (3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol?
(3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol has a molecular weight of 153.22 g/mol, XLogP of 1.18, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z)-5-amino-8-methylcycloocta-3,5-dien-1-ol is sourced from PubChem (CID 174024874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).