6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide

C17H22N4O3 — CID 164938831

IUPAC6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide
SMILESCc1oc2ncnc(NC3(C)CC3)c2c1C(=O)NCC1CCOC1
InChIInChI=1S/C17H22N4O3/c1-10-12(15(22)18-7-11-3-6-23-8-11)13-14(21-17(2)4-5-17)19-9-20-16(13)24-10/h9,11H,3-8H2,1-2H3,(H,18,22)(H,19,20,21)
InChIKeyCDHFDGWJYNTPOM-UHFFFAOYSA-N
MW330.39 g/mol
LogP2.26
Rot. Bonds5

About 6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide

6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide (PubChem CID 164938831) has the molecular formula C17H22N4O3 and a molecular weight of 330.39 g/mol. Its IUPAC name is 6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide.

Molecular Properties

Compound Name6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide
PubChem CID164938831
Molecular FormulaC17H22N4O3
Molecular Weight330.39 g/mol
Exact Mass330.17
IUPAC Name6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide
SMILESCc1oc2ncnc(NC3(C)CC3)c2c1C(=O)NCC1CCOC1
InChIInChI=1S/C17H22N4O3/c1-10-12(15(22)18-7-11-3-6-23-8-11)13-14(21-17(2)4-5-17)19-9-20-16(13)24-10/h9,11H,3-8H2,1-2H3,(H,18,22)(H,19,20,21)
InChIKeyCDHFDGWJYNTPOM-UHFFFAOYSA-N
XLogP2.26
TPSA89.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide with MolForge

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Related Compounds

6-methyl-4-[(1-methylcyclopropyl)amino]-N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[2,3-d]pyrimidine-5-carboxamide
CID 138635742
N-[(6-chloro-3-pyridinyl)methyl]-6-methyl-4-[(1-methylcyclopropyl)amino]furo[2,3-d]pyrimidine-5-carboxamide
CID 138635237
6-methyl-4-[(1-methylcyclopropyl)amino]-N-[2-(2-methylphenoxy)ethyl]furo[2,3-d]pyrimidine-5-carboxamide
CID 170209511
N,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide
CID 170208855
6-methyl-4-[(1-methylcyclopropyl)amino]-N-[[5-(trifluoromethyl)-2,5-dihydro-1,2,4-oxadiazol-3-yl]methyl]furo[2,3-d]pyrimidine-5-carboxamide
CID 166763354
6-methyl-4-[(1-methylcyclopropyl)amino]-N-(6-methylpyridazin-3-yl)furo[2,3-d]pyrimidine-5-carboxamide
CID 138635155
N-[(4-fluoro-3-nitrophenyl)methyl]-6-methyl-4-[(1-methylcyclopropyl)amino]furo[2,3-d]pyrimidine-5-carboxamide
CID 138635526
6-methyl-4-[(1-methylcyclopropyl)amino]-N-(2-methylpyrazol-3-yl)furo[2,3-d]pyrimidine-5-carboxamide
CID 138635753
N-[[1-(3-fluorophenyl)cyclopentyl]methyl]-6-methyl-4-[(1-methylcyclopropyl)amino]furo[2,3-d]pyrimidine-5-carboxamide
CID 138636028
N-[[4-(1-fluoroethyl)pyrimidin-2-yl]methyl]-6-methyl-4-[(1-methylcyclopropyl)amino]furo[2,3-d]pyrimidine-5-carboxamide
CID 170209809
N-[1-(4-fluorophenyl)propan-2-yl]-6-methyl-4-[(1-methylcyclopropyl)amino]furo[2,3-d]pyrimidine-5-carboxamide
CID 138635915
N,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(5-methyl-1,3-thiazol-2-yl)methyl]furo[2,3-d]pyrimidine-5-carboxamide
CID 138635301

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide?
The IUPAC name of 6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide (CID 164938831) is 6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide.
What is the SMILES notation for 6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide?
The canonical SMILES for 6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide is Cc1oc2ncnc(NC3(C)CC3)c2c1C(=O)NCC1CCOC1.
What is the InChIKey of 6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide?
The InChIKey is CDHFDGWJYNTPOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3/c1-10-12(15(22)18-7-11-3-6-23-8-11)13-14(21-17(2)4-5-17)19-9-20-16(13)24-10/h9,11H,3-8H2,1-2H3,(H,18,22)(H,19,20,21).
What are the key properties of 6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide?
6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide has a molecular weight of 330.39 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-[(1-methylcyclopropyl)amino]-N-(oxolan-3-ylmethyl)furo[2,3-d]pyrimidine-5-carboxamide is sourced from PubChem (CID 164938831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).