(Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol

C12H23NO — CID 164669056

IUPAC(Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol
SMILESC/C=C\C(N1CCCCC1)C(C)(C)O
InChIInChI=1S/C12H23NO/c1-4-8-11(12(2,3)14)13-9-6-5-7-10-13/h4,8,11,14H,5-7,9-10H2,1-3H3/b8-4-
InChIKeyVQTRBGVPZQEZSY-YWEYNIOJSA-N
MW197.32 g/mol
LogP2.19
Rot. Bonds3

About (Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol

(Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol (PubChem CID 164669056) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is (Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol.

Molecular Properties

Compound Name(Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol
PubChem CID164669056
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name(Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol
SMILESC/C=C\C(N1CCCCC1)C(C)(C)O
InChIInChI=1S/C12H23NO/c1-4-8-11(12(2,3)14)13-9-6-5-7-10-13/h4,8,11,14H,5-7,9-10H2,1-3H3/b8-4-
InChIKeyVQTRBGVPZQEZSY-YWEYNIOJSA-N
XLogP2.19
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2R,3S)-3-methyl-2-(piperidin-1-yl)hex-5-en-3-ol
CID 178185652
1-(Methylethyl)-4-prop-2-enylpiperidin-4-ol
CID 5200463
(E)-2,5-dimethyl-6-piperidin-1-ylhex-4-en-2-ol
CID 12625783
2,6-Dimethyl-4-piperidin-1-ylhept-5-en-2-ol
CID 20385825
(E)-2,6-dimethyl-6-piperidin-1-ylhept-4-en-2-ol
CID 20385826
2,6-Dimethyl-6-piperidino-4-hepten-2-ol
CID 54023182
2,5-Dimethyl-6-piperidinohex-4-en-2-ol
CID 54073601
3,7-Dimethyl-4-piperidin-1-yloct-6-en-3-ol
CID 13356332
2-Piperidin-1-ylcyclopent-3-en-1-ol
CID 15617621
(1R,2R)-2-piperidin-1-ylcyclopent-3-en-1-ol
CID 15617622
1-Cyclohex-2-en-1-yl-3-methylpyrrolidin-3-ol
CID 103728388
1-Cyclohex-2-en-1-yl-3-ethylazetidin-3-ol
CID 114620777

Frequently Asked Questions

What is the IUPAC name of (Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol?
The IUPAC name of (Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol (CID 164669056) is (Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol.
What is the SMILES notation for (Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol?
The canonical SMILES for (Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol is C/C=C\C(N1CCCCC1)C(C)(C)O.
What is the InChIKey of (Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol?
The InChIKey is VQTRBGVPZQEZSY-YWEYNIOJSA-N. The full InChI is InChI=1S/C12H23NO/c1-4-8-11(12(2,3)14)13-9-6-5-7-10-13/h4,8,11,14H,5-7,9-10H2,1-3H3/b8-4-.
What are the key properties of (Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol?
(Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol has a molecular weight of 197.32 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-methyl-3-piperidin-1-ylhex-4-en-2-ol is sourced from PubChem (CID 164669056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).