3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide

C19H20N4O — CID 73301288

IUPAC3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide
SMILESCc1c(CN(C)C(=O)C=Cc2ccc(N)nc2)[nH]c2ccccc12
InChIInChI=1S/C19H20N4O/c1-13-15-5-3-4-6-16(15)22-17(13)12-23(2)19(24)10-8-14-7-9-18(20)21-11-14/h3-11,22H,12H2,1-2H3,(H2,20,21)
InChIKeyRMQMECKLHVIGEC-UHFFFAOYSA-N
MW320.40 g/mol
LogP3.13
Rot. Bonds4

About 3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide

3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide (PubChem CID 73301288) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is 3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide.

Molecular Properties

Compound Name3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide
PubChem CID73301288
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide
SMILESCc1c(CN(C)C(=O)C=Cc2ccc(N)nc2)[nH]c2ccccc12
InChIInChI=1S/C19H20N4O/c1-13-15-5-3-4-6-16(15)22-17(13)12-23(2)19(24)10-8-14-7-9-18(20)21-11-14/h3-11,22H,12H2,1-2H3,(H2,20,21)
InChIKeyRMQMECKLHVIGEC-UHFFFAOYSA-N
XLogP3.13
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide 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

N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]-3-(2-oxo-1,5-dihydropyrido[2,3-e][1,4]oxazepin-7-yl)prop-2-enamide
CID 68913817
(E)-3-(6-amino-3-pyridinyl)-N-[1-(1H-indol-3-yl)ethyl]-N-methylprop-2-enamide
CID 22593705
3-(6-amino-3-pyridinyl)-N-methyl-N-[(1R)-1-(3-methyl-1-benzofuran-2-yl)ethyl]prop-2-enamide
CID 91199817
3-(6-amino-3-pyridinyl)-N-[1-(3-ethyl-1-benzofuran-2-yl)ethyl]-N-methylprop-2-enamide
CID 68912214
(E)-3-(6-amino-3-pyridinyl)-N-methyl-N-[(Z)-2-(N-methylanilino)hex-2-enyl]prop-2-enamide
CID 142907224
3-(6-amino-3-pyridinyl)-N-methyl-N-[(1-methylpyrrolo[3,2-b]pyridin-3-yl)methyl]prop-2-enamide
CID 66905038
N,N-dimethyl-1-(3-methyl-1H-indol-2-yl)methanamine
CID 119082195
3-(6-amino-3-pyridinyl)-N-[(4,6-dichloro-1-methylindol-2-yl)methyl]-N-methylprop-2-enamide
CID 66780792
N-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide
CID 56756856
(Z)-3-(6-amino-3-pyridinyl)prop-2-enoic acid
CID 95473874
(E)-3-(6-amino-3-pyridinyl)-N-methyl-N-[1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]prop-2-enamide
CID 66780654
3-[[acetyl(methyl)amino]methyl]-4-amino-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]benzamide
CID 70145463

Frequently Asked Questions

What is the IUPAC name of 3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide?
The IUPAC name of 3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide (CID 73301288) is 3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide.
What is the SMILES notation for 3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide?
The canonical SMILES for 3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide is Cc1c(CN(C)C(=O)C=Cc2ccc(N)nc2)[nH]c2ccccc12.
What is the InChIKey of 3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide?
The InChIKey is RMQMECKLHVIGEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-13-15-5-3-4-6-16(15)22-17(13)12-23(2)19(24)10-8-14-7-9-18(20)21-11-14/h3-11,22H,12H2,1-2H3,(H2,20,21).
What are the key properties of 3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide?
3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide has a molecular weight of 320.40 g/mol, XLogP of 3.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide is sourced from PubChem (CID 73301288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).