(E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol

C8H18N2O — CID 55254052

IUPAC(E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol
SMILESC/C(=C\N(C)C)CC(N)CO
InChIInChI=1S/C8H18N2O/c1-7(5-10(2)3)4-8(9)6-11/h5,8,11H,4,6,9H2,1-3H3/b7-5+
InChIKeyITJVPSSWZPWDLV-FNORWQNLSA-N
MW158.24 g/mol
LogP0.16
Rot. Bonds4

About (E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol

(E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol (PubChem CID 55254052) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is (E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol.

Molecular Properties

Compound Name(E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol
PubChem CID55254052
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name(E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol
SMILESC/C(=C\N(C)C)CC(N)CO
InChIInChI=1S/C8H18N2O/c1-7(5-10(2)3)4-8(9)6-11/h5,8,11H,4,6,9H2,1-3H3/b7-5+
InChIKeyITJVPSSWZPWDLV-FNORWQNLSA-N
XLogP0.16
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol?
The IUPAC name of (E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol (CID 55254052) is (E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol.
What is the SMILES notation for (E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol?
The canonical SMILES for (E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol is C/C(=C\N(C)C)CC(N)CO.
What is the InChIKey of (E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol?
The InChIKey is ITJVPSSWZPWDLV-FNORWQNLSA-N. The full InChI is InChI=1S/C8H18N2O/c1-7(5-10(2)3)4-8(9)6-11/h5,8,11H,4,6,9H2,1-3H3/b7-5+.
What are the key properties of (E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol?
(E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol has a molecular weight of 158.24 g/mol, XLogP of 0.16, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-amino-5-(dimethylamino)-4-methylpent-4-en-1-ol is sourced from PubChem (CID 55254052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).