N-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine

C19H24N2 — CID 142955193

IUPACN-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine
SMILESC=C/C=C\C(=C)CC(=C)/C=C\C(=C)NC1=C(C)C=NCC1
InChIInChI=1S/C19H24N2/c1-6-7-8-15(2)13-16(3)9-10-18(5)21-19-11-12-20-14-17(19)4/h6-10,14,21H,1-3,5,11-13H2,4H3/b8-7-,10-9-
InChIKeyHZUXAZWBAYIQAH-QRLRYFCNSA-N
MW280.41 g/mol
LogP4.64
Rot. Bonds8

About N-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine

N-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine (PubChem CID 142955193) has the molecular formula C19H24N2 and a molecular weight of 280.41 g/mol. Its IUPAC name is N-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine.

Molecular Properties

Compound NameN-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine
PubChem CID142955193
Molecular FormulaC19H24N2
Molecular Weight280.41 g/mol
Exact Mass280.19
IUPAC NameN-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine
SMILESC=C/C=C\C(=C)CC(=C)/C=C\C(=C)NC1=C(C)C=NCC1
InChIInChI=1S/C19H24N2/c1-6-7-8-15(2)13-16(3)9-10-18(5)21-19-11-12-20-14-17(19)4/h6-10,14,21H,1-3,5,11-13H2,4H3/b8-7-,10-9-
InChIKeyHZUXAZWBAYIQAH-QRLRYFCNSA-N
XLogP4.64
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine?
The IUPAC name of N-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine (CID 142955193) is N-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine.
What is the SMILES notation for N-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine?
The canonical SMILES for N-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine is C=C/C=C\C(=C)CC(=C)/C=C\C(=C)NC1=C(C)C=NCC1.
What is the InChIKey of N-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine?
The InChIKey is HZUXAZWBAYIQAH-QRLRYFCNSA-N. The full InChI is InChI=1S/C19H24N2/c1-6-7-8-15(2)13-16(3)9-10-18(5)21-19-11-12-20-14-17(19)4/h6-10,14,21H,1-3,5,11-13H2,4H3/b8-7-,10-9-.
What are the key properties of N-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine?
N-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine has a molecular weight of 280.41 g/mol, XLogP of 4.64, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3Z,8Z)-5,7-dimethylideneundeca-1,3,8,10-tetraen-2-yl]-5-methyl-2,3-dihydropyridin-4-amine is sourced from PubChem (CID 142955193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).