2-methyl-1-quinazolin-4-ylpiperidin-4-amine

C14H18N4 — CID 66801029

IUPAC2-methyl-1-quinazolin-4-ylpiperidin-4-amine
SMILESCC1CC(N)CCN1c1ncnc2ccccc12
InChIInChI=1S/C14H18N4/c1-10-8-11(15)6-7-18(10)14-12-4-2-3-5-13(12)16-9-17-14/h2-5,9-11H,6-8,15H2,1H3
InChIKeyIHGZTNFJTUHCHJ-UHFFFAOYSA-N
MW242.33 g/mol
LogP1.95
Rot. Bonds1

About 2-methyl-1-quinazolin-4-ylpiperidin-4-amine

2-methyl-1-quinazolin-4-ylpiperidin-4-amine (PubChem CID 66801029) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is 2-methyl-1-quinazolin-4-ylpiperidin-4-amine.

Molecular Properties

Compound Name2-methyl-1-quinazolin-4-ylpiperidin-4-amine
PubChem CID66801029
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC Name2-methyl-1-quinazolin-4-ylpiperidin-4-amine
SMILESCC1CC(N)CCN1c1ncnc2ccccc12
InChIInChI=1S/C14H18N4/c1-10-8-11(15)6-7-18(10)14-12-4-2-3-5-13(12)16-9-17-14/h2-5,9-11H,6-8,15H2,1H3
InChIKeyIHGZTNFJTUHCHJ-UHFFFAOYSA-N
XLogP1.95
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-quinazolin-4-ylpiperidin-4-amine?
The IUPAC name of 2-methyl-1-quinazolin-4-ylpiperidin-4-amine (CID 66801029) is 2-methyl-1-quinazolin-4-ylpiperidin-4-amine.
What is the SMILES notation for 2-methyl-1-quinazolin-4-ylpiperidin-4-amine?
The canonical SMILES for 2-methyl-1-quinazolin-4-ylpiperidin-4-amine is CC1CC(N)CCN1c1ncnc2ccccc12.
What is the InChIKey of 2-methyl-1-quinazolin-4-ylpiperidin-4-amine?
The InChIKey is IHGZTNFJTUHCHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c1-10-8-11(15)6-7-18(10)14-12-4-2-3-5-13(12)16-9-17-14/h2-5,9-11H,6-8,15H2,1H3.
What are the key properties of 2-methyl-1-quinazolin-4-ylpiperidin-4-amine?
2-methyl-1-quinazolin-4-ylpiperidin-4-amine has a molecular weight of 242.33 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-quinazolin-4-ylpiperidin-4-amine is sourced from PubChem (CID 66801029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).