4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline

C19H20N4 — CID 659902

IUPAC4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline
SMILESCC1CCCCN1c1nc(-c2ccncc2)nc2ccccc12
InChIInChI=1S/C19H20N4/c1-14-6-4-5-13-23(14)19-16-7-2-3-8-17(16)21-18(22-19)15-9-11-20-12-10-15/h2-3,7-12,14H,4-6,13H2,1H3
InChIKeyOXWFTMXZJCILRG-UHFFFAOYSA-N
MW304.40 g/mol
LogP4.07
Rot. Bonds2

About 4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline

4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline (PubChem CID 659902) has the molecular formula C19H20N4 and a molecular weight of 304.40 g/mol. Its IUPAC name is 4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline.

Molecular Properties

Compound Name4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline
PubChem CID659902
Molecular FormulaC19H20N4
Molecular Weight304.40 g/mol
Exact Mass304.17
IUPAC Name4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline
SMILESCC1CCCCN1c1nc(-c2ccncc2)nc2ccccc12
InChIInChI=1S/C19H20N4/c1-14-6-4-5-13-23(14)19-16-7-2-3-8-17(16)21-18(22-19)15-9-11-20-12-10-15/h2-3,7-12,14H,4-6,13H2,1H3
InChIKeyOXWFTMXZJCILRG-UHFFFAOYSA-N
XLogP4.07
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.40
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline?
The IUPAC name of 4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline (CID 659902) is 4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline.
What is the SMILES notation for 4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline?
The canonical SMILES for 4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline is CC1CCCCN1c1nc(-c2ccncc2)nc2ccccc12.
What is the InChIKey of 4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline?
The InChIKey is OXWFTMXZJCILRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4/c1-14-6-4-5-13-23(14)19-16-7-2-3-8-17(16)21-18(22-19)15-9-11-20-12-10-15/h2-3,7-12,14H,4-6,13H2,1H3.
What are the key properties of 4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline?
4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline has a molecular weight of 304.40 g/mol, XLogP of 4.07, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpiperidin-1-yl)-2-pyridin-4-ylquinazoline is sourced from PubChem (CID 659902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).