N-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide

C18H20N4O — CID 56756856

IUPACN-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide
SMILESCNc1ncccc1C(=O)N(C)Cc1[nH]c2ccccc2c1C
InChIInChI=1S/C18H20N4O/c1-12-13-7-4-5-9-15(13)21-16(12)11-22(3)18(23)14-8-6-10-20-17(14)19-2/h4-10,21H,11H2,1-3H3,(H,19,20)
InChIKeyCQMWTRCTNPKLQV-UHFFFAOYSA-N
MW308.39 g/mol
LogP3.19
Rot. Bonds4

About N-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide

N-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide (PubChem CID 56756856) has the molecular formula C18H20N4O and a molecular weight of 308.39 g/mol. Its IUPAC name is N-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide
PubChem CID56756856
Molecular FormulaC18H20N4O
Molecular Weight308.39 g/mol
Exact Mass308.16
IUPAC NameN-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide
SMILESCNc1ncccc1C(=O)N(C)Cc1[nH]c2ccccc2c1C
InChIInChI=1S/C18H20N4O/c1-12-13-7-4-5-9-15(13)21-16(12)11-22(3)18(23)14-8-6-10-20-17(14)19-2/h4-10,21H,11H2,1-3H3,(H,19,20)
InChIKeyCQMWTRCTNPKLQV-UHFFFAOYSA-N
XLogP3.19
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(4-bromophenyl)methyl]-N-methyl-2-(methylamino)pyridine-3-carboxamide
CID 62176252
N-methyl-2-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridine-3-carboxamide
CID 55134622
N-[(3-fluorophenyl)methyl]-N-methyl-2-(methylamino)pyridine-3-carboxamide
CID 62170886
N-[(3-chlorophenyl)methyl]-N-methyl-2-(methylamino)pyridine-3-carboxamide
CID 62179082
N,N-dimethyl-1-(3-methyl-1H-indol-2-yl)methanamine
CID 119082195
N,1,3-trimethyl-N-[(3-methyl-1H-indol-2-yl)methyl]-2,6-dioxopyrimidine-4-carboxamide
CID 72838254
N-methyl-2-(methylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 62166706
1-[2-(methylamino)-3-pyridinyl]butan-1-one
CID 59932550
3-[[acetyl(methyl)amino]methyl]-4-amino-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]benzamide
CID 70145463
3-(6-amino-3-pyridinyl)-N-methyl-N-[(3-methyl-1H-indol-2-yl)methyl]prop-2-enamide
CID 73301288
N-methyl-2-(methylamino)-N-(oxan-4-ylmethyl)pyridine-3-carboxamide
CID 63706966
2-(ethylamino)-N-[(4-fluorophenyl)methyl]-N-methylpyridine-3-carboxamide
CID 62176798

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide?
The IUPAC name of N-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide (CID 56756856) is N-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide?
The canonical SMILES for N-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide is CNc1ncccc1C(=O)N(C)Cc1[nH]c2ccccc2c1C.
What is the InChIKey of N-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide?
The InChIKey is CQMWTRCTNPKLQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O/c1-12-13-7-4-5-9-15(13)21-16(12)11-22(3)18(23)14-8-6-10-20-17(14)19-2/h4-10,21H,11H2,1-3H3,(H,19,20).
What are the key properties of N-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide?
N-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide has a molecular weight of 308.39 g/mol, XLogP of 3.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(methylamino)-N-[(3-methyl-1H-indol-2-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 56756856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).