N-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide

C11H15N3O2 — CID 170387996

IUPACN-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide
SMILESCCC(=O)Nc1cnc(OC)nc1C1CC1
InChIInChI=1S/C11H15N3O2/c1-3-9(15)13-8-6-12-11(16-2)14-10(8)7-4-5-7/h6-7H,3-5H2,1-2H3,(H,13,15)
InChIKeyHGKDHDXNYJAWKN-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.71
Rot. Bonds4

About N-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide

N-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide (PubChem CID 170387996) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide.

Molecular Properties

Compound NameN-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide
PubChem CID170387996
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide
SMILESCCC(=O)Nc1cnc(OC)nc1C1CC1
InChIInChI=1S/C11H15N3O2/c1-3-9(15)13-8-6-12-11(16-2)14-10(8)7-4-5-7/h6-7H,3-5H2,1-2H3,(H,13,15)
InChIKeyHGKDHDXNYJAWKN-UHFFFAOYSA-N
XLogP1.71
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide?
The IUPAC name of N-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide (CID 170387996) is N-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide.
What is the SMILES notation for N-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide?
The canonical SMILES for N-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide is CCC(=O)Nc1cnc(OC)nc1C1CC1.
What is the InChIKey of N-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide?
The InChIKey is HGKDHDXNYJAWKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-3-9(15)13-8-6-12-11(16-2)14-10(8)7-4-5-7/h6-7H,3-5H2,1-2H3,(H,13,15).
What are the key properties of N-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide?
N-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide has a molecular weight of 221.26 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopropyl-2-methoxypyrimidin-5-yl)propanamide is sourced from PubChem (CID 170387996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).