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

C22H25N9O — CID 139450017

IUPAC2-N-(4,6-dimethyl-2-pyridinyl)-6-N-imidazo[1,2-a]pyridin-7-yl-4-N-morpholin-4-ylpyrimidine-2,4,6-triamine
SMILESCc1cc(C)nc(Nc2nc(Nc3ccn4ccnc4c3)cc(NN3CCOCC3)n2)c1
InChIInChI=1S/C22H25N9O/c1-15-11-16(2)24-18(12-15)26-22-27-19(14-20(28-22)29-31-7-9-32-10-8-31)25-17-3-5-30-6-4-23-21(30)13-17/h3-6,11-14H,7-10H2,1-2H3,(H3,24,25,26,27,28,29)
InChIKeyVPJOTDWWIMESNA-UHFFFAOYSA-N
MW431.50 g/mol
LogP3.28
Rot. Bonds6

About 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

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 (PubChem CID 139450017) has the molecular formula C22H25N9O and a molecular weight of 431.50 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name2-N-(4,6-dimethyl-2-pyridinyl)-6-N-imidazo[1,2-a]pyridin-7-yl-4-N-morpholin-4-ylpyrimidine-2,4,6-triamine
PubChem CID139450017
Molecular FormulaC22H25N9O
Molecular Weight431.50 g/mol
Exact Mass431.22
IUPAC Name2-N-(4,6-dimethyl-2-pyridinyl)-6-N-imidazo[1,2-a]pyridin-7-yl-4-N-morpholin-4-ylpyrimidine-2,4,6-triamine
SMILESCc1cc(C)nc(Nc2nc(Nc3ccn4ccnc4c3)cc(NN3CCOCC3)n2)c1
InChIInChI=1S/C22H25N9O/c1-15-11-16(2)24-18(12-15)26-22-27-19(14-20(28-22)29-31-7-9-32-10-8-31)25-17-3-5-30-6-4-23-21(30)13-17/h3-6,11-14H,7-10H2,1-2H3,(H3,24,25,26,27,28,29)
InChIKeyVPJOTDWWIMESNA-UHFFFAOYSA-N
XLogP3.28
TPSA104.53 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.50
LogP ≤ 53.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Analyze 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 with MolForge

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Launch Full Analysis

Related Compounds

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-chloro-4-methyl-2-pyridinyl)-4-N-imidazo[1,2-a]pyridin-7-yl-6-piperidin-1-ylpyrimidine-2,4-diamine
CID 139450142
4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4,6-triamine
CID 139450238
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
6-ethoxy-4-N-imidazo[1,2-a]pyridin-7-yl-2-N-(4-methyl-2-pyridinyl)pyrimidine-2,4-diamine
CID 139450077
4-N-imidazo[1,2-a]pyridin-7-yl-6-morpholin-4-yl-2-N-(6-propan-2-yloxy-3-pyridinyl)pyrimidine-2,4-diamine
CID 139450029
2-N-(6-butoxy-3-pyridinyl)-4-N-imidazo[1,2-a]pyridin-7-yl-6-morpholin-4-ylpyrimidine-2,4-diamine
CID 139450069
3-[[4-(imidazo[1,2-a]pyridin-7-ylamino)-6-morpholin-4-ylpyrimidin-2-yl]amino]-5-(trifluoromethyl)phenol
CID 145179646
N-[3-[[4-(imidazo[1,2-a]pyridin-7-ylamino)-6-morpholin-4-ylpyrimidin-2-yl]amino]-5-(trifluoromethyl)phenyl]acetamide
CID 145179634
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-(2-methylpyrimidin-4-yl)morpholin-4-amine
CID 83025498
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

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is Cc1cc(C)nc(Nc2nc(Nc3ccn4ccnc4c3)cc(NN3CCOCC3)n2)c1.
What is the InChIKey of 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?
The InChIKey is VPJOTDWWIMESNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N9O/c1-15-11-16(2)24-18(12-15)26-22-27-19(14-20(28-22)29-31-7-9-32-10-8-31)25-17-3-5-30-6-4-23-21(30)13-17/h3-6,11-14H,7-10H2,1-2H3,(H3,24,25,26,27,28,29).
What are the key properties of 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?
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 has a molecular weight of 431.50 g/mol, XLogP of 3.28, 6 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 139450017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).