(10Z)-docosa-10,21-dien-1-amine

C22H43N — CID 153323384

IUPAC(10Z)-docosa-10,21-dien-1-amine
SMILESC=CCCCCCCCCC/C=C\CCCCCCCCCN
InChIInChI=1S/C22H43N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h2,12-13H,1,3-11,14-23H2/b13-12-
InChIKeyJQBPWDJMXRFRHJ-SEYXRHQNSA-N
MW321.59 g/mol
LogP7.32
Rot. Bonds19

About (10Z)-docosa-10,21-dien-1-amine

(10Z)-docosa-10,21-dien-1-amine (PubChem CID 153323384) has the molecular formula C22H43N and a molecular weight of 321.59 g/mol. Its IUPAC name is (10Z)-docosa-10,21-dien-1-amine.

Molecular Properties

Compound Name(10Z)-docosa-10,21-dien-1-amine
PubChem CID153323384
Molecular FormulaC22H43N
Molecular Weight321.59 g/mol
Exact Mass321.34
IUPAC Name(10Z)-docosa-10,21-dien-1-amine
SMILESC=CCCCCCCCCC/C=C\CCCCCCCCCN
InChIInChI=1S/C22H43N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h2,12-13H,1,3-11,14-23H2/b13-12-
InChIKeyJQBPWDJMXRFRHJ-SEYXRHQNSA-N
XLogP7.32
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds19
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.59
LogP ≤ 57.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

heptadec-16-en-1-amine
CID 15590771
(5E)-deca-5,9-dien-1-amine
CID 144887868
(3E)-undeca-3,10-dien-1-amine
CID 107010613
docos-21-en-1-amine;hydrochloride
CID 153323410
icosa-1,9,19-triene
CID 57001912
heptahexaconta-1,23,66-triene
CID 57275880
tetradec-7-ene-1,14-diamine
CID 91430908
dodeca-1,6,11-triene
CID 548864
heptacosa-1,26-diene
CID 58905535
heptadeca-1,16-diene
CID 6429392
(1Z)-nona-1,8-dien-1-amine
CID 149197195
pentacosa-1,16-diene
CID 57082437

Frequently Asked Questions

What is the IUPAC name of (10Z)-docosa-10,21-dien-1-amine?
The IUPAC name of (10Z)-docosa-10,21-dien-1-amine (CID 153323384) is (10Z)-docosa-10,21-dien-1-amine.
What is the SMILES notation for (10Z)-docosa-10,21-dien-1-amine?
The canonical SMILES for (10Z)-docosa-10,21-dien-1-amine is C=CCCCCCCCCC/C=C\CCCCCCCCCN.
What is the InChIKey of (10Z)-docosa-10,21-dien-1-amine?
The InChIKey is JQBPWDJMXRFRHJ-SEYXRHQNSA-N. The full InChI is InChI=1S/C22H43N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h2,12-13H,1,3-11,14-23H2/b13-12-.
What are the key properties of (10Z)-docosa-10,21-dien-1-amine?
(10Z)-docosa-10,21-dien-1-amine has a molecular weight of 321.59 g/mol, XLogP of 7.32, 19 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (10Z)-docosa-10,21-dien-1-amine is sourced from PubChem (CID 153323384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).