(2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine

C13H23N — CID 134186425

IUPAC(2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine
SMILESC=C(C)N(C)/C(C)=C/C=C\CCCC
InChIInChI=1S/C13H23N/c1-6-7-8-9-10-11-13(4)14(5)12(2)3/h9-11H,2,6-8H2,1,3-5H3/b10-9-,13-11+
InChIKeySQYIQBMXJUFJNV-AZQRDTPRSA-N
MW193.33 g/mol
LogP4.10
Rot. Bonds6

About (2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine

(2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine (PubChem CID 134186425) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is (2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine.

Molecular Properties

Compound Name(2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine
PubChem CID134186425
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC Name(2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine
SMILESC=C(C)N(C)/C(C)=C/C=C\CCCC
InChIInChI=1S/C13H23N/c1-6-7-8-9-10-11-13(4)14(5)12(2)3/h9-11H,2,6-8H2,1,3-5H3/b10-9-,13-11+
InChIKeySQYIQBMXJUFJNV-AZQRDTPRSA-N
XLogP4.10
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,1-difluoroocta-1,3-diene
CID 150749668
2,2-difluoro-3-methyldeca-3,5-diene
CID 123813972
(2E,4Z)-3-fluoronona-2,4-diene;(2E,4Z)-2-fluoroocta-2,4-diene
CID 143078029
1,1-dichloroocta-1,3-diene;palladium
CID 87090262
(2E,4E)-2-prop-2-enoxynona-2,4-diene
CID 87210955
2-methylprop-2-enoic acid;octadeca-9,11,13-trienoic acid
CID 174415565
triaconta-1,3,5,7,9,11,13,15,17,19,21,23,25-tridecaene
CID 91195237
(5Z)-dodeca-5,7-dien-5-ol
CID 87161212
2,3-dimethyltrideca-2,4,6,8-tetraene
CID 173035438
N-methyl-N-[(E)-[(2E,4E)-2-methylundeca-2,4-dienylidene]amino]methanamine
CID 24740811
2-methylundeca-1,6-diene
CID 173154459
(3E,5E)-2-(trifluoromethyl)deca-1,3,5-triene
CID 10888998

Frequently Asked Questions

What is the IUPAC name of (2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine?
The IUPAC name of (2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine (CID 134186425) is (2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine.
What is the SMILES notation for (2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine?
The canonical SMILES for (2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine is C=C(C)N(C)/C(C)=C/C=C\CCCC.
What is the InChIKey of (2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine?
The InChIKey is SQYIQBMXJUFJNV-AZQRDTPRSA-N. The full InChI is InChI=1S/C13H23N/c1-6-7-8-9-10-11-13(4)14(5)12(2)3/h9-11H,2,6-8H2,1,3-5H3/b10-9-,13-11+.
What are the key properties of (2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine?
(2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine has a molecular weight of 193.33 g/mol, XLogP of 4.10, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4Z)-N-methyl-N-prop-1-en-2-ylnona-2,4-dien-2-amine is sourced from PubChem (CID 134186425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).