6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine

C19H19N7O — CID 139450077

IUPAC6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine
SMILESCCOc1cc(Nc2ccn3ccnc3c2)nc(Nc2cc(C)ccn2)n1
InChIInChI=1S/C19H19N7O/c1-3-27-18-12-16(22-14-5-8-26-9-7-21-17(26)11-14)24-19(25-18)23-15-10-13(2)4-6-20-15/h4-12H,3H2,1-2H3,(H2,20,22,23,24,25)
InChIKeyYIHQBVPWQODAMG-UHFFFAOYSA-N
MW361.41 g/mol
LogP3.71
Rot. Bonds6

About 6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine

6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine (PubChem CID 139450077) has the molecular formula C19H19N7O and a molecular weight of 361.41 g/mol. Its IUPAC name is 6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine
PubChem CID139450077
Molecular FormulaC19H19N7O
Molecular Weight361.41 g/mol
Exact Mass361.17
IUPAC Name6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine
SMILESCCOc1cc(Nc2ccn3ccnc3c2)nc(Nc2cc(C)ccn2)n1
InChIInChI=1S/C19H19N7O/c1-3-27-18-12-16(22-14-5-8-26-9-7-21-17(26)11-14)24-19(25-18)23-15-10-13(2)4-6-20-15/h4-12H,3H2,1-2H3,(H2,20,22,23,24,25)
InChIKeyYIHQBVPWQODAMG-UHFFFAOYSA-N
XLogP3.71
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.41
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4,6-triamine
CID 139450238
2-N-(6-chloro-4-methyl-2-pyridinyl)-4-N-imidazo[1,2-a]pyridin-7-yl-6-piperidin-1-ylpyrimidine-2,4-diamine
CID 139450142
2-N-(4,6-dimethyl-2-pyridinyl)-6-N-imidazo[1,2-a]pyridin-7-yl-4-N-morpholin-4-ylpyrimidine-2,4,6-triamine
CID 139450017
6-N-imidazo[1,2-a]pyridin-7-yl-4-N,4-N,2-trimethylpyrimidine-4,6-diamine;molecular hydrogen
CID 145179642
6-[(3S)-3,4-dimethylpiperazin-1-yl]-2-N-(4,6-dimethyl-2-pyridinyl)-4-N-imidazo[1,2-a]pyridin-7-ylpyrimidine-2,4-diamine
CID 139450015
2-N-(6-butoxy-3-pyridinyl)-4-N-imidazo[1,2-a]pyridin-7-yl-6-morpholin-4-ylpyrimidine-2,4-diamine
CID 139450069
4-N-imidazo[1,2-a]pyridin-7-yl-6-piperidin-1-yl-2-N-(6-propan-2-yloxy-3-pyridinyl)pyrimidine-2,4-diamine
CID 139450018
6-[(3S,4S)-3,4-dimethylpyrrolidin-1-yl]-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-[6-(2-methylpropyl)-2-pyridinyl]pyrimidine-2,4-diamine
CID 139450070
2-N-[6-[2-(dimethylamino)ethoxy]-3-pyridinyl]-4-N-imidazo[1,2-a]pyridin-7-yl-6-morpholin-4-ylpyrimidine-2,4-diamine
CID 139450095
N-(3,5-dimethylphenyl)-4-methylpyridin-2-amine
CID 53414319
6-[(3S)-3,4-dimethylpiperazin-1-yl]-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(6-propan-2-yloxy-3-pyridinyl)pyrimidine-2,4-diamine
CID 139450216
4-N-imidazo[1,2-a]pyridin-7-yl-6-morpholin-4-yl-2-N-(3,4,5-trifluorophenyl)pyrimidine-2,4-diamine
CID 145179637

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine?
The IUPAC name of 6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine (CID 139450077) is 6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine.
What is the SMILES notation for 6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine?
The canonical SMILES for 6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine is CCOc1cc(Nc2ccn3ccnc3c2)nc(Nc2cc(C)ccn2)n1.
What is the InChIKey of 6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine?
The InChIKey is YIHQBVPWQODAMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N7O/c1-3-27-18-12-16(22-14-5-8-26-9-7-21-17(26)11-14)24-19(25-18)23-15-10-13(2)4-6-20-15/h4-12H,3H2,1-2H3,(H2,20,22,23,24,25).
What are the key properties of 6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine?
6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine has a molecular weight of 361.41 g/mol, XLogP of 3.71, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine is sourced from PubChem (CID 139450077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).