(Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine

C15H22N4 — CID 134484489

IUPAC(Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine
SMILESC=N/C(C)=C\N(C)N(C)/C=C(\NC)c1ccccc1
InChIInChI=1S/C15H22N4/c1-13(16-2)11-18(4)19(5)12-15(17-3)14-9-7-6-8-10-14/h6-12,17H,2H2,1,3-5H3/b13-11-,15-12-
InChIKeyJXNDMZDTAPFMLN-LJACRCCUSA-N
MW258.37 g/mol
LogP2.54
Rot. Bonds6

About (Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine

(Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine (PubChem CID 134484489) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is (Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine.

Molecular Properties

Compound Name(Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine
PubChem CID134484489
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC Name(Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine
SMILESC=N/C(C)=C\N(C)N(C)/C=C(\NC)c1ccccc1
InChIInChI=1S/C15H22N4/c1-13(16-2)11-18(4)19(5)12-15(17-3)14-9-7-6-8-10-14/h6-12,17H,2H2,1,3-5H3/b13-11-,15-12-
InChIKeyJXNDMZDTAPFMLN-LJACRCCUSA-N
XLogP2.54
TPSA30.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(Z)-2-(methylamino)-2-phenylethenethiol
CID 88954703
(Z)-3-(methylamino)-3-phenylprop-2-enoic acid
CID 69082862
(E)-2-isocyano-N-methyl-1-phenylethenamine
CID 10583060
(E)-1-(methylamino)-1-phenylpent-1-en-3-one
CID 121010171
(Z)-3-(methylamino)-N,3-diphenylprop-2-enamide
CID 25157764
1,1-dimethyl-2-[(E)-1-phenylbut-1-enyl]hydrazine
CID 101358658
ethyl 3-(methylamino)-3-phenylprop-2-enoate
CID 58005139
(E)-4-(methylamino)-1-phenylpent-3-en-1-one
CID 121007705
(E)-N-methyl-2-(4-methylphenyl)sulfonyl-1-phenylethenamine
CID 24972823
(E)-2-benzoyl-3-(dimethylamino)-N-phenylprop-2-enamide
CID 87529383
N-[(E)-1-phenylprop-2-enylideneamino]methanamine
CID 144603752
(Z)-2-N-methyl-1-phenylprop-1-ene-1,2-diamine
CID 145093299

Frequently Asked Questions

What is the IUPAC name of (Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine?
The IUPAC name of (Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine (CID 134484489) is (Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine.
What is the SMILES notation for (Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine?
The canonical SMILES for (Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine is C=N/C(C)=C\N(C)N(C)/C=C(\NC)c1ccccc1.
What is the InChIKey of (Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine?
The InChIKey is JXNDMZDTAPFMLN-LJACRCCUSA-N. The full InChI is InChI=1S/C15H22N4/c1-13(16-2)11-18(4)19(5)12-15(17-3)14-9-7-6-8-10-14/h6-12,17H,2H2,1,3-5H3/b13-11-,15-12-.
What are the key properties of (Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine?
(Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine has a molecular weight of 258.37 g/mol, XLogP of 2.54, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-methyl-2-[methyl-[methyl-[(Z)-2-(methylideneamino)prop-1-enyl]amino]amino]-1-phenylethenamine is sourced from PubChem (CID 134484489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).