N-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide

C18H23N7O3 — CID 166738347

IUPACN-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide
SMILESCNC(=O)c1cc2nc(Nc3cc(C(C)C)[nH]n3)nc(N3CCOCC3)c2o1
InChIInChI=1S/C18H23N7O3/c1-10(2)11-9-14(24-23-11)21-18-20-12-8-13(17(26)19-3)28-15(12)16(22-18)25-4-6-27-7-5-25/h8-10H,4-7H2,1-3H3,(H,19,26)(H2,20,21,22,23,24)
InChIKeyIGVDYNHQYZIAOY-UHFFFAOYSA-N
MW385.43 g/mol
LogP2.01
Rot. Bonds5

About N-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide

N-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide (PubChem CID 166738347) has the molecular formula C18H23N7O3 and a molecular weight of 385.43 g/mol. Its IUPAC name is N-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide
PubChem CID166738347
Molecular FormulaC18H23N7O3
Molecular Weight385.43 g/mol
Exact Mass385.19
IUPAC NameN-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide
SMILESCNC(=O)c1cc2nc(Nc3cc(C(C)C)[nH]n3)nc(N3CCOCC3)c2o1
InChIInChI=1S/C18H23N7O3/c1-10(2)11-9-14(24-23-11)21-18-20-12-8-13(17(26)19-3)28-15(12)16(22-18)25-4-6-27-7-5-25/h8-10H,4-7H2,1-3H3,(H,19,26)(H2,20,21,22,23,24)
InChIKeyIGVDYNHQYZIAOY-UHFFFAOYSA-N
XLogP2.01
TPSA121.20 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.43
LogP ≤ 52.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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Related Compounds

4-morpholin-4-yl-6-pyridin-4-yl-N-(5-thiophen-3-yl-1H-pyrazol-3-yl)furo[3,2-d]pyrimidin-2-amine
CID 166738481
4-morpholin-4-yl-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-ylfuro[3,2-d]pyrimidin-2-amine
CID 166164600
N-[5-(2-methyl-4-pyridinyl)-1H-pyrazol-3-yl]-4-morpholin-4-yl-6-pyridin-4-ylfuro[3,2-d]pyrimidin-2-amine;hydrochloride
CID 166164944
6-[[2-methoxyethyl(methyl)amino]methyl]-4-morpholin-4-yl-N-(5-phenyl-1H-pyrazol-3-yl)furo[3,2-d]pyrimidin-2-amine
CID 168728066
2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide
CID 86618417
2-[[1-(dimethylsulfamoyl)-3-phenylpyrazol-5-yl]amino]-N-methylsulfonyl-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide
CID 166164460
2-[1-[[2-[(5-methyl-1H-pyrazol-3-yl)amino]-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-6-yl]methyl]piperidin-4-yl]propan-2-ol
CID 53378052
2-chloro-5-fluoro-N-(5-methyl-1H-pyrazol-3-yl)-6-morpholin-4-ylpyrimidin-4-amine;2,2,2-trifluoroacetic acid
CID 50993955
N-cyclopropyl-2-[3-(3-methylphenyl)pyrazol-1-yl]-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide
CID 168728145
2,4,5-trimethyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)furan-3-carboxamide
CID 112689360
N-cyclopentyl-2-(2-methylhydrazinyl)-4-morpholin-4-yl-5H-pyrrolo[3,2-d]pyrimidine-6-carboxamide
CID 139293306
4-morpholin-4-yl-N-(oxan-4-yl)-2-(4-phenylpyrazol-1-yl)furo[3,2-d]pyrimidine-6-carboxamide
CID 166738354

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide?
The IUPAC name of N-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide (CID 166738347) is N-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide.
What is the SMILES notation for N-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide?
The canonical SMILES for N-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide is CNC(=O)c1cc2nc(Nc3cc(C(C)C)[nH]n3)nc(N3CCOCC3)c2o1.
What is the InChIKey of N-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide?
The InChIKey is IGVDYNHQYZIAOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N7O3/c1-10(2)11-9-14(24-23-11)21-18-20-12-8-13(17(26)19-3)28-15(12)16(22-18)25-4-6-27-7-5-25/h8-10H,4-7H2,1-3H3,(H,19,26)(H2,20,21,22,23,24).
What are the key properties of N-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide?
N-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide has a molecular weight of 385.43 g/mol, XLogP of 2.01, 5 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-morpholin-4-yl-2-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]furo[3,2-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 166738347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).