2-(1-propylcyclopropyl)pyrimidine

C10H14N2 — CID 57120822

IUPAC2-(1-propylcyclopropyl)pyrimidine
SMILESCCCC1(c2ncccn2)CC1
InChIInChI=1S/C10H14N2/c1-2-4-10(5-6-10)9-11-7-3-8-12-9/h3,7-8H,2,4-6H2,1H3
InChIKeyBFWCFHWEBHKCAX-UHFFFAOYSA-N
MW162.24 g/mol
LogP2.31
Rot. Bonds3

About 2-(1-propylcyclopropyl)pyrimidine

2-(1-propylcyclopropyl)pyrimidine (PubChem CID 57120822) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 2-(1-propylcyclopropyl)pyrimidine.

Molecular Properties

Compound Name2-(1-propylcyclopropyl)pyrimidine
PubChem CID57120822
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name2-(1-propylcyclopropyl)pyrimidine
SMILESCCCC1(c2ncccn2)CC1
InChIInChI=1S/C10H14N2/c1-2-4-10(5-6-10)9-11-7-3-8-12-9/h3,7-8H,2,4-6H2,1H3
InChIKeyBFWCFHWEBHKCAX-UHFFFAOYSA-N
XLogP2.31
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-propylcyclopropyl)pyrimidine?
The IUPAC name of 2-(1-propylcyclopropyl)pyrimidine (CID 57120822) is 2-(1-propylcyclopropyl)pyrimidine.
What is the SMILES notation for 2-(1-propylcyclopropyl)pyrimidine?
The canonical SMILES for 2-(1-propylcyclopropyl)pyrimidine is CCCC1(c2ncccn2)CC1.
What is the InChIKey of 2-(1-propylcyclopropyl)pyrimidine?
The InChIKey is BFWCFHWEBHKCAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-2-4-10(5-6-10)9-11-7-3-8-12-9/h3,7-8H,2,4-6H2,1H3.
What are the key properties of 2-(1-propylcyclopropyl)pyrimidine?
2-(1-propylcyclopropyl)pyrimidine has a molecular weight of 162.24 g/mol, XLogP of 2.31, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-propylcyclopropyl)pyrimidine is sourced from PubChem (CID 57120822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).