(3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine

C8H14N2 — CID 142057520

IUPAC(3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine
SMILESC=C/C=C\C(CNC)=N\C
InChIInChI=1S/C8H14N2/c1-4-5-6-8(10-3)7-9-2/h4-6,9H,1,7H2,2-3H3/b6-5-,10-8-
InChIKeyUFZILEAZDHUVSJ-XUTLIFGGSA-N
MW138.21 g/mol
LogP1.02
Rot. Bonds4

About (3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine

(3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine (PubChem CID 142057520) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is (3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine.

Molecular Properties

Compound Name(3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine
PubChem CID142057520
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name(3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine
SMILESC=C/C=C\C(CNC)=N\C
InChIInChI=1S/C8H14N2/c1-4-5-6-8(10-3)7-9-2/h4-6,9H,1,7H2,2-3H3/b6-5-,10-8-
InChIKeyUFZILEAZDHUVSJ-XUTLIFGGSA-N
XLogP1.02
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-Methyl-7-(methylimino)-1,3,5-cycloheptatrien-1-amine
CID 939724
Pyrroloazocine
CID 137224559
methyl-[(3E,5E)-6-(methylamino)hepta-3,5-dien-2-ylidene]azanium
CID 57895519
N-methyl-1-(2H-pyrrol-5-yl)methanamine
CID 58270092
(4-Methylidenecyclohexa-2,5-dien-1-ylidene)-propylazanium
CID 59057511
1H-cyclohepta[b]pyrazine
CID 68550528
1-(4H-azepin-7-yl)-N-methylmethanamine
CID 91307733
2-imino-N-(2-iminopent-3-enyl)pent-3-en-1-amine
CID 123169571
N-methyl-2-methyliminopent-3-en-1-amine
CID 123205396
(Z)-2-methyliminohex-3-en-1-amine
CID 123256608
N-methyl-1-[[(2Z,5Z)-octa-2,5,7-trien-4-ylidene]amino]ethane-1,2-diamine
CID 123475839
2-Methyliminohexa-3,5-dien-1-amine
CID 123554614

Frequently Asked Questions

What is the IUPAC name of (3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine?
The IUPAC name of (3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine (CID 142057520) is (3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine.
What is the SMILES notation for (3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine?
The canonical SMILES for (3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine is C=C/C=C\C(CNC)=N\C.
What is the InChIKey of (3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine?
The InChIKey is UFZILEAZDHUVSJ-XUTLIFGGSA-N. The full InChI is InChI=1S/C8H14N2/c1-4-5-6-8(10-3)7-9-2/h4-6,9H,1,7H2,2-3H3/b6-5-,10-8-.
What are the key properties of (3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine?
(3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine has a molecular weight of 138.21 g/mol, XLogP of 1.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-N-methyl-2-methyliminohexa-3,5-dien-1-amine is sourced from PubChem (CID 142057520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).