(Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol

C13H25NO — CID 14315763

IUPAC(Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol
SMILESC/C(=C/C(C)(C)O)CNC1CCCCC1
InChIInChI=1S/C13H25NO/c1-11(9-13(2,3)15)10-14-12-7-5-4-6-8-12/h9,12,14-15H,4-8,10H2,1-3H3/b11-9-
InChIKeyRRJKLIOJDGOUDD-LUAWRHEFSA-N
MW211.35 g/mol
LogP2.63
Rot. Bonds4

About (Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol

(Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol (PubChem CID 14315763) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is (Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol.

Molecular Properties

Compound Name(Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol
PubChem CID14315763
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name(Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol
SMILESC/C(=C/C(C)(C)O)CNC1CCCCC1
InChIInChI=1S/C13H25NO/c1-11(9-13(2,3)15)10-14-12-7-5-4-6-8-12/h9,12,14-15H,4-8,10H2,1-3H3/b11-9-
InChIKeyRRJKLIOJDGOUDD-LUAWRHEFSA-N
XLogP2.63
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

9-(Cyclohexylamino)-2,6-dimethylnona-2,6-dien-1-ol
CID 70435118
(2E,6E)-9-(cyclohexylamino)-2,6-dimethylnona-2,6-dien-1-ol
CID 88662138
(6E)-9-(cyclohexylamino)-2,6-dimethylnona-2,6-dien-1-ol
CID 140347081
(Z)-5-(cyclohexylamino)-2-methylpent-3-en-2-ol
CID 14315755
(Z)-2,4-dimethyl-5-(propan-2-ylamino)pent-3-en-2-ol
CID 14398058
1-(Cyclohex-2-en-1-ylamino)-2-methylpropan-2-ol
CID 107907097
(3E,5E)-7-(hexylamino)-6-methylocta-1,3,5-trien-4-ol
CID 143074594

Frequently Asked Questions

What is the IUPAC name of (Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol?
The IUPAC name of (Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol (CID 14315763) is (Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol.
What is the SMILES notation for (Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol?
The canonical SMILES for (Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol is C/C(=C/C(C)(C)O)CNC1CCCCC1.
What is the InChIKey of (Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol?
The InChIKey is RRJKLIOJDGOUDD-LUAWRHEFSA-N. The full InChI is InChI=1S/C13H25NO/c1-11(9-13(2,3)15)10-14-12-7-5-4-6-8-12/h9,12,14-15H,4-8,10H2,1-3H3/b11-9-.
What are the key properties of (Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol?
(Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol has a molecular weight of 211.35 g/mol, XLogP of 2.63, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-(cyclohexylamino)-2,4-dimethylpent-3-en-2-ol is sourced from PubChem (CID 14315763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).