(2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol

C6H11NO — CID 167253684

IUPAC(2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol
SMILESCC(/C=C\N)=C/CO
InChIInChI=1S/C6H11NO/c1-6(2-4-7)3-5-8/h2-4,8H,5,7H2,1H3/b4-2-,6-3-
InChIKeyNXBNKPSLTXBBTF-ZUMAWFIWSA-N
MW113.16 g/mol
LogP0.40
Rot. Bonds2

About (2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol

(2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol (PubChem CID 167253684) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is (2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol.

Molecular Properties

Compound Name(2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol
PubChem CID167253684
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name(2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol
SMILESCC(/C=C\N)=C/CO
InChIInChI=1S/C6H11NO/c1-6(2-4-7)3-5-8/h2-4,8H,5,7H2,1H3/b4-2-,6-3-
InChIKeyNXBNKPSLTXBBTF-ZUMAWFIWSA-N
XLogP0.40
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-Methyl-1,2-dihydropyridin-2-ol
CID 57618840
1H-azepin-4-ylmethanol
CID 70473240
5-Aminopenta-2,4-dien-1-ol
CID 76224447
(3Z,5Z)-6-amino-5-methylhexa-1,3,5-trien-2-ol
CID 87152872
(1E,3Z)-1-amino-5-methylhexa-1,3,5-trien-2-ol
CID 88274704
(2E)-2-[(Z)-2-aminoethenyl]-4-bromopenta-2,4-dien-1-ol
CID 88539128
(2E)-2-[(Z)-2-aminoethenyl]penta-2,4-dien-1-ol
CID 89187292
(3Z,5Z)-6-amino-4-ethyl-2-methylidenehexa-3,5-dien-1-ol
CID 89208831
(2E,4Z)-2-[(Z)-2-aminoethenyl]hexa-2,4-dien-1-ol
CID 135196934
ethenol;(1E)-3-methylbuta-1,3-dien-1-amine
CID 141786533
(Z,2E)-4-amino-2-(aminomethylidene)but-3-en-1-ol
CID 143178256
6-Amino-3-methylhexa-1,3,5-trien-2-ol;ethane
CID 143713797

Frequently Asked Questions

What is the IUPAC name of (2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol?
The IUPAC name of (2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol (CID 167253684) is (2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol.
What is the SMILES notation for (2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol?
The canonical SMILES for (2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol is CC(/C=C\N)=C/CO.
What is the InChIKey of (2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol?
The InChIKey is NXBNKPSLTXBBTF-ZUMAWFIWSA-N. The full InChI is InChI=1S/C6H11NO/c1-6(2-4-7)3-5-8/h2-4,8H,5,7H2,1H3/b4-2-,6-3-.
What are the key properties of (2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol?
(2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol has a molecular weight of 113.16 g/mol, XLogP of 0.40, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4Z)-5-amino-3-methylpenta-2,4-dien-1-ol is sourced from PubChem (CID 167253684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).