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

C18H24N4O2 — CID 170208855

IUPACN,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide
SMILESCc1oc2ncnc(NC3(C)CC3)c2c1C(=O)N(C)CC1(C)CC1
InChIInChI=1S/C18H24N4O2/c1-11-12(16(23)22(4)9-17(2)5-6-17)13-14(21-18(3)7-8-18)19-10-20-15(13)24-11/h10H,5-9H2,1-4H3,(H,19,20,21)
InChIKeyOYTWTMLLUIGITD-UHFFFAOYSA-N
MW328.42 g/mol
LogP3.37
Rot. Bonds5

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

N,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide (PubChem CID 170208855) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is N,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide
PubChem CID170208855
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC NameN,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide
SMILESCc1oc2ncnc(NC3(C)CC3)c2c1C(=O)N(C)CC1(C)CC1
InChIInChI=1S/C18H24N4O2/c1-11-12(16(23)22(4)9-17(2)5-6-17)13-14(21-18(3)7-8-18)19-10-20-15(13)24-11/h10H,5-9H2,1-4H3,(H,19,20,21)
InChIKeyOYTWTMLLUIGITD-UHFFFAOYSA-N
XLogP3.37
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide?
The IUPAC name of N,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide (CID 170208855) is N,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide.
What is the SMILES notation for N,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide?
The canonical SMILES for N,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide is Cc1oc2ncnc(NC3(C)CC3)c2c1C(=O)N(C)CC1(C)CC1.
What is the InChIKey of N,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide?
The InChIKey is OYTWTMLLUIGITD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-11-12(16(23)22(4)9-17(2)5-6-17)13-14(21-18(3)7-8-18)19-10-20-15(13)24-11/h10H,5-9H2,1-4H3,(H,19,20,21).
What are the key properties of N,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide?
N,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-4-[(1-methylcyclopropyl)amino]-N-[(1-methylcyclopropyl)methyl]furo[2,3-d]pyrimidine-5-carboxamide is sourced from PubChem (CID 170208855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).