2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine

C17H19N3 — CID 67421880

IUPAC2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine
SMILESCc1ccccc1CNc1nccc2c(C)c(C)[nH]c12
InChIInChI=1S/C17H19N3/c1-11-6-4-5-7-14(11)10-19-17-16-15(8-9-18-17)12(2)13(3)20-16/h4-9,20H,10H2,1-3H3,(H,18,19)
InChIKeyQDEPLPBRQKVAGH-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.10
Rot. Bonds3

About 2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine

2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine (PubChem CID 67421880) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine.

Molecular Properties

Compound Name2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine
PubChem CID67421880
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC Name2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine
SMILESCc1ccccc1CNc1nccc2c(C)c(C)[nH]c12
InChIInChI=1S/C17H19N3/c1-11-6-4-5-7-14(11)10-19-17-16-15(8-9-18-17)12(2)13(3)20-16/h4-9,20H,10H2,1-3H3,(H,18,19)
InChIKeyQDEPLPBRQKVAGH-UHFFFAOYSA-N
XLogP4.10
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dimethyl-N-[[2-(trifluoromethyl)phenyl]methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine
CID 67421486
3-(2,3-dimethyl-1H-pyrrolo[2,3-c]pyridin-7-yl)-N-[(2-methylphenyl)methyl]propan-1-amine;hydrochloride
CID 67141912
2,3-dimethyl-N-[(2-methylphenyl)methyl]-1-propylpyrrolo[2,3-c]pyridin-7-amine
CID 67141915
N-[(2-chlorophenyl)methyl]-9H-pyrido[3,4-b]indol-1-amine
CID 56676786
6-methoxy-N-[(2-methylphenyl)methyl]isoquinolin-1-amine
CID 106537699
N-[1-(2,3-dimethyl-1H-pyrrolo[2,3-c]pyridin-7-yl)-2-(2-methylphenyl)ethyl]-4-fluoro-N-methylaniline
CID 67141789
1-methyl-3-[(2-methylphenyl)methylamino]pyrazin-2-one
CID 62938866
N-[(2-methylphenyl)methyl]-2-pyridin-3-ylquinazolin-4-amine
CID 9251567
2-methyl-7-[(2-methylphenyl)methylamino]-1-propylpyrrolo[2,3-c]pyridine-3-carbaldehyde
CID 87392794
1-ethyl-3-[(2-methylphenyl)methylamino]pyrazin-2-one
CID 62938284
1-N,4-N-bis[(2-methylphenyl)methyl]benzene-1,4-diamine
CID 102345817
4-N,4-N-diethyl-2-N-[(2-methylphenyl)methyl]pyrimidine-2,4-diamine
CID 112889893

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine?
The IUPAC name of 2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine (CID 67421880) is 2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine.
What is the SMILES notation for 2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine?
The canonical SMILES for 2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine is Cc1ccccc1CNc1nccc2c(C)c(C)[nH]c12.
What is the InChIKey of 2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine?
The InChIKey is QDEPLPBRQKVAGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-11-6-4-5-7-14(11)10-19-17-16-15(8-9-18-17)12(2)13(3)20-16/h4-9,20H,10H2,1-3H3,(H,18,19).
What are the key properties of 2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine?
2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine has a molecular weight of 265.36 g/mol, XLogP of 4.10, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-[(2-methylphenyl)methyl]-1H-pyrrolo[2,3-c]pyridin-7-amine is sourced from PubChem (CID 67421880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).