N-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine

C9H16N2 — CID 90945235

IUPACN-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine
SMILESCC=CC=C(C)N(C)N=CC
InChIInChI=1S/C9H16N2/c1-5-7-8-9(3)11(4)10-6-2/h5-8H,1-4H3
InChIKeyYCLLKIOGSIILAT-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.40
Rot. Bonds3

About N-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine

N-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine (PubChem CID 90945235) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is N-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine.

Molecular Properties

Compound NameN-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine
PubChem CID90945235
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC NameN-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine
SMILESCC=CC=C(C)N(C)N=CC
InChIInChI=1S/C9H16N2/c1-5-7-8-9(3)11(4)10-6-2/h5-8H,1-4H3
InChIKeyYCLLKIOGSIILAT-UHFFFAOYSA-N
XLogP2.40
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

(2Z)-N-[(Z)-ethylideneamino]-3-fluoro-N-methylpenta-2,4-dien-2-amine
CID 138701610
(Z)-N-(4-fluoro-2-methylidene-1-pyridinyl)ethanimine
CID 139374508
1-Methyl-6-methylidenepyridazine
CID 57558126
(Z)-N-(2-methyl-6-methylidene-1-pyridinyl)ethanimine
CID 88272988
(2Z,4Z,6Z)-N-methyl-N-(methylideneamino)nona-2,4,6,8-tetraen-2-amine
CID 88328215
(6Z)-1-methyl-6-prop-2-enylidenepyridazine
CID 88886126
(1Z)-N-[(Z)-ethylideneamino]-N-propan-2-ylbuta-1,3-dien-1-amine
CID 88922600
(1Z)-N-[(Z)-ethylideneamino]-N-prop-1-en-2-ylbuta-1,3-dien-1-amine
CID 88923578
6-Methylidene-1-propan-2-ylpyridazine
CID 89502125
N-methyl-N-(prop-2-enylideneamino)hexa-2,4-dien-2-amine
CID 91026933
2-hexa-2,4-dien-2-yl-1-methyl-3H-pyridazin-1-ium
CID 91147295
2-hexa-2,4-dien-2-yl-3H-pyridazine
CID 91540705

Frequently Asked Questions

What is the IUPAC name of N-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine?
The IUPAC name of N-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine (CID 90945235) is N-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine.
What is the SMILES notation for N-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine?
The canonical SMILES for N-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine is CC=CC=C(C)N(C)N=CC.
What is the InChIKey of N-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine?
The InChIKey is YCLLKIOGSIILAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-5-7-8-9(3)11(4)10-6-2/h5-8H,1-4H3.
What are the key properties of N-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine?
N-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine has a molecular weight of 152.24 g/mol, XLogP of 2.40, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylideneamino)-N-methylhexa-2,4-dien-2-amine is sourced from PubChem (CID 90945235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).