(4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol

C14H24O — CID 57074679

IUPAC(4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol
SMILESC=C1C=C[C@H](C(C)C)CCC(O)CCC1
InChIInChI=1S/C14H24O/c1-11(2)13-8-7-12(3)5-4-6-14(15)10-9-13/h7-8,11,13-15H,3-6,9-10H2,1-2H3/t13-,14?/m0/s1
InChIKeyUWZALWBEMWSGMH-LSLKUGRBSA-N
MW208.34 g/mol
LogP3.70
Rot. Bonds1

About (4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol

(4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol (PubChem CID 57074679) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is (4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol.

Molecular Properties

Compound Name(4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol
PubChem CID57074679
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Name(4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol
SMILESC=C1C=C[C@H](C(C)C)CCC(O)CCC1
InChIInChI=1S/C14H24O/c1-11(2)13-8-7-12(3)5-4-6-14(15)10-9-13/h7-8,11,13-15H,3-6,9-10H2,1-2H3/t13-,14?/m0/s1
InChIKeyUWZALWBEMWSGMH-LSLKUGRBSA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol?
The IUPAC name of (4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol (CID 57074679) is (4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol.
What is the SMILES notation for (4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol?
The canonical SMILES for (4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol is C=C1C=C[C@H](C(C)C)CCC(O)CCC1.
What is the InChIKey of (4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol?
The InChIKey is UWZALWBEMWSGMH-LSLKUGRBSA-N. The full InChI is InChI=1S/C14H24O/c1-11(2)13-8-7-12(3)5-4-6-14(15)10-9-13/h7-8,11,13-15H,3-6,9-10H2,1-2H3/t13-,14?/m0/s1.
What are the key properties of (4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol?
(4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol has a molecular weight of 208.34 g/mol, XLogP of 3.70, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-7-methylidene-4-propan-2-ylcyclodec-5-en-1-ol is sourced from PubChem (CID 57074679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).