(E)-3-amino-2-methylhex-3-en-2-ol

C7H15NO — CID 149202432

IUPAC(E)-3-amino-2-methylhex-3-en-2-ol
SMILESCC/C=C(/N)C(C)(C)O
InChIInChI=1S/C7H15NO/c1-4-5-6(8)7(2,3)9/h5,9H,4,8H2,1-3H3/b6-5+
InChIKeyXEYMRFSIZINEEF-AATRIKPKSA-N
MW129.20 g/mol
LogP1.01
Rot. Bonds2

About (E)-3-amino-2-methylhex-3-en-2-ol

(E)-3-amino-2-methylhex-3-en-2-ol (PubChem CID 149202432) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is (E)-3-amino-2-methylhex-3-en-2-ol.

Molecular Properties

Compound Name(E)-3-amino-2-methylhex-3-en-2-ol
PubChem CID149202432
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name(E)-3-amino-2-methylhex-3-en-2-ol
SMILESCC/C=C(/N)C(C)(C)O
InChIInChI=1S/C7H15NO/c1-4-5-6(8)7(2,3)9/h5,9H,4,8H2,1-3H3/b6-5+
InChIKeyXEYMRFSIZINEEF-AATRIKPKSA-N
XLogP1.01
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (E)-3-amino-2-methylhex-3-en-2-ol?
The IUPAC name of (E)-3-amino-2-methylhex-3-en-2-ol (CID 149202432) is (E)-3-amino-2-methylhex-3-en-2-ol.
What is the SMILES notation for (E)-3-amino-2-methylhex-3-en-2-ol?
The canonical SMILES for (E)-3-amino-2-methylhex-3-en-2-ol is CC/C=C(/N)C(C)(C)O.
What is the InChIKey of (E)-3-amino-2-methylhex-3-en-2-ol?
The InChIKey is XEYMRFSIZINEEF-AATRIKPKSA-N. The full InChI is InChI=1S/C7H15NO/c1-4-5-6(8)7(2,3)9/h5,9H,4,8H2,1-3H3/b6-5+.
What are the key properties of (E)-3-amino-2-methylhex-3-en-2-ol?
(E)-3-amino-2-methylhex-3-en-2-ol has a molecular weight of 129.20 g/mol, XLogP of 1.01, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-amino-2-methylhex-3-en-2-ol is sourced from PubChem (CID 149202432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).