2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine

C14H19N3 — CID 70333077

IUPAC2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine
SMILESCN1CC=C(c2cnc(CC3CC3)nc2)CC1
InChIInChI=1S/C14H19N3/c1-17-6-4-12(5-7-17)13-9-15-14(16-10-13)8-11-2-3-11/h4,9-11H,2-3,5-8H2,1H3
InChIKeyADWNQIZBLXVSKK-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.15
Rot. Bonds3

About 2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine

2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine (PubChem CID 70333077) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine.

Molecular Properties

Compound Name2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine
PubChem CID70333077
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine
SMILESCN1CC=C(c2cnc(CC3CC3)nc2)CC1
InChIInChI=1S/C14H19N3/c1-17-6-4-12(5-7-17)13-9-15-14(16-10-13)8-11-2-3-11/h4,9-11H,2-3,5-8H2,1H3
InChIKeyADWNQIZBLXVSKK-UHFFFAOYSA-N
XLogP2.15
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine?
The IUPAC name of 2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine (CID 70333077) is 2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine.
What is the SMILES notation for 2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine?
The canonical SMILES for 2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine is CN1CC=C(c2cnc(CC3CC3)nc2)CC1.
What is the InChIKey of 2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine?
The InChIKey is ADWNQIZBLXVSKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-17-6-4-12(5-7-17)13-9-15-14(16-10-13)8-11-2-3-11/h4,9-11H,2-3,5-8H2,1H3.
What are the key properties of 2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine?
2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine has a molecular weight of 229.33 g/mol, XLogP of 2.15, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethyl)-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyrimidine is sourced from PubChem (CID 70333077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).