N,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine

C18H22N4 — CID 137474602

IUPACN,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine
SMILESCc1ccccc1Cn1c(CN(C)C)nc2nccc(C)c21
InChIInChI=1S/C18H22N4/c1-13-7-5-6-8-15(13)11-22-16(12-21(3)4)20-18-17(22)14(2)9-10-19-18/h5-10H,11-12H2,1-4H3
InChIKeyAEWZLCXCEVFXJQ-UHFFFAOYSA-N
MW294.40 g/mol
LogP3.16
Rot. Bonds4

About N,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine

N,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine (PubChem CID 137474602) has the molecular formula C18H22N4 and a molecular weight of 294.40 g/mol. Its IUPAC name is N,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine
PubChem CID137474602
Molecular FormulaC18H22N4
Molecular Weight294.40 g/mol
Exact Mass294.18
IUPAC NameN,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine
SMILESCc1ccccc1Cn1c(CN(C)C)nc2nccc(C)c21
InChIInChI=1S/C18H22N4/c1-13-7-5-6-8-15(13)11-22-16(12-21(3)4)20-18-17(22)14(2)9-10-19-18/h5-10H,11-12H2,1-4H3
InChIKeyAEWZLCXCEVFXJQ-UHFFFAOYSA-N
XLogP3.16
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-[[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]methyl]pyridine-2-carboxamide
CID 16966843
4-N-[2-(2-methylphenyl)ethyl]pyrimidine-2,4-diamine
CID 80850064
N,N-dimethyl-1-[2-[(3E)-5-(3-methyl-2-pyridinyl)hexa-1,3,5-trien-2-yl]phenyl]methanamine
CID 138480551
2-benzyl-3-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridine
CID 117165030
N-ethyl-N-[(2-methylphenyl)methyl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 133383992
2-[methyl-[1-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]piperidin-4-yl]amino]-1H-pyrimidin-6-one
CID 176915310
2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol
CID 17027842
4-N,4-N-diethyl-2-N-[(2-methylphenyl)methyl]pyrimidine-2,4-diamine
CID 112889893
3-[(2-methylphenyl)methyl]pteridin-4-one
CID 39826329
1-[(2-methylphenyl)methyl]-2-phenylbenzimidazole
CID 1320430
1-[3-hydroxy-5-methyl-2-(2-methylphenyl)imidazol-4-yl]-N,N-dimethylmethanamine
CID 23332858
N,N-dimethyl-1-(3-methyl-2-pyridinyl)methanamine
CID 20666322

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine?
The IUPAC name of N,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine (CID 137474602) is N,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine is Cc1ccccc1Cn1c(CN(C)C)nc2nccc(C)c21.
What is the InChIKey of N,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine?
The InChIKey is AEWZLCXCEVFXJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4/c1-13-7-5-6-8-15(13)11-22-16(12-21(3)4)20-18-17(22)14(2)9-10-19-18/h5-10H,11-12H2,1-4H3.
What are the key properties of N,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine?
N,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine has a molecular weight of 294.40 g/mol, XLogP of 3.16, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[7-methyl-1-[(2-methylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methanamine is sourced from PubChem (CID 137474602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).