N-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide

C10H13N3O3 — CID 4648751

IUPACN-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide
SMILESCOc1cc(C(=O)NC2CC2)nc(OC)n1
InChIInChI=1S/C10H13N3O3/c1-15-8-5-7(12-10(13-8)16-2)9(14)11-6-3-4-6/h5-6H,3-4H2,1-2H3,(H,11,14)
InChIKeyYTTCZLABOHUNOA-UHFFFAOYSA-N
MW223.23 g/mol
LogP0.39
Rot. Bonds4

About N-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide

N-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide (PubChem CID 4648751) has the molecular formula C10H13N3O3 and a molecular weight of 223.23 g/mol. Its IUPAC name is N-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide
PubChem CID4648751
Molecular FormulaC10H13N3O3
Molecular Weight223.23 g/mol
Exact Mass223.10
IUPAC NameN-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide
SMILESCOc1cc(C(=O)NC2CC2)nc(OC)n1
InChIInChI=1S/C10H13N3O3/c1-15-8-5-7(12-10(13-8)16-2)9(14)11-6-3-4-6/h5-6H,3-4H2,1-2H3,(H,11,14)
InChIKeyYTTCZLABOHUNOA-UHFFFAOYSA-N
XLogP0.39
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide?
The IUPAC name of N-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide (CID 4648751) is N-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide?
The canonical SMILES for N-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide is COc1cc(C(=O)NC2CC2)nc(OC)n1.
What is the InChIKey of N-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide?
The InChIKey is YTTCZLABOHUNOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3/c1-15-8-5-7(12-10(13-8)16-2)9(14)11-6-3-4-6/h5-6H,3-4H2,1-2H3,(H,11,14).
What are the key properties of N-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide?
N-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide has a molecular weight of 223.23 g/mol, XLogP of 0.39, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2,6-dimethoxypyrimidine-4-carboxamide is sourced from PubChem (CID 4648751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).