(Z)-4,5-diaminopent-4-en-1-ol

C5H12N2O — CID 145148062

IUPAC(Z)-4,5-diaminopent-4-en-1-ol
SMILESN/C=C(\N)CCCO
InChIInChI=1S/C5H12N2O/c6-4-5(7)2-1-3-8/h4,8H,1-3,6-7H2/b5-4-
InChIKeyDPOPWHHBBPFDJG-PLNGDYQASA-N
MW116.16 g/mol
LogP-0.48
Rot. Bonds3

About (Z)-4,5-diaminopent-4-en-1-ol

(Z)-4,5-diaminopent-4-en-1-ol (PubChem CID 145148062) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is (Z)-4,5-diaminopent-4-en-1-ol.

Molecular Properties

Compound Name(Z)-4,5-diaminopent-4-en-1-ol
PubChem CID145148062
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC Name(Z)-4,5-diaminopent-4-en-1-ol
SMILESN/C=C(\N)CCCO
InChIInChI=1S/C5H12N2O/c6-4-5(7)2-1-3-8/h4,8H,1-3,6-7H2/b5-4-
InChIKeyDPOPWHHBBPFDJG-PLNGDYQASA-N
XLogP-0.48
TPSA72.27 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 5-0.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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6-hydroxyhexanamide
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18-hydroxyoctadecanamide
CID 54261687
ethane;formamide;heptane-1,7-diol
CID 176682059
CID 175591031
CID 175591031
1-(4-hydroxybutanoylamino)-1-(hydroxymethyl)urea
CID 139981079
6-aminooct-5-en-1-ol;azane
CID 173397334
prop-2-enyl 4-hydroxybutanoate
CID 11367059
(E)-4-(chloromethyl)hex-4-en-1-ol
CID 12869748
4-hydroxy-N-[2-(4-hydroxybutanoylamino)ethyl]butanamide
CID 95562402

Frequently Asked Questions

What is the IUPAC name of (Z)-4,5-diaminopent-4-en-1-ol?
The IUPAC name of (Z)-4,5-diaminopent-4-en-1-ol (CID 145148062) is (Z)-4,5-diaminopent-4-en-1-ol.
What is the SMILES notation for (Z)-4,5-diaminopent-4-en-1-ol?
The canonical SMILES for (Z)-4,5-diaminopent-4-en-1-ol is N/C=C(\N)CCCO.
What is the InChIKey of (Z)-4,5-diaminopent-4-en-1-ol?
The InChIKey is DPOPWHHBBPFDJG-PLNGDYQASA-N. The full InChI is InChI=1S/C5H12N2O/c6-4-5(7)2-1-3-8/h4,8H,1-3,6-7H2/b5-4-.
What are the key properties of (Z)-4,5-diaminopent-4-en-1-ol?
(Z)-4,5-diaminopent-4-en-1-ol has a molecular weight of 116.16 g/mol, XLogP of -0.48, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4,5-diaminopent-4-en-1-ol is sourced from PubChem (CID 145148062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).