N-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine

C15H24N4 — CID 62191304

IUPACN-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine
SMILESCCNc1nc(N2CCCCC2)nc2c1CCCC2
InChIInChI=1S/C15H24N4/c1-2-16-14-12-8-4-5-9-13(12)17-15(18-14)19-10-6-3-7-11-19/h2-11H2,1H3,(H,16,17,18)
InChIKeyQKCCRMLXJJOQRT-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.78
Rot. Bonds3

About N-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine

N-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine (PubChem CID 62191304) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is N-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine
PubChem CID62191304
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC NameN-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine
SMILESCCNc1nc(N2CCCCC2)nc2c1CCCC2
InChIInChI=1S/C15H24N4/c1-2-16-14-12-8-4-5-9-13(12)17-15(18-14)19-10-6-3-7-11-19/h2-11H2,1H3,(H,16,17,18)
InChIKeyQKCCRMLXJJOQRT-UHFFFAOYSA-N
XLogP2.78
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine?
The IUPAC name of N-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine (CID 62191304) is N-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine.
What is the SMILES notation for N-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine?
The canonical SMILES for N-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine is CCNc1nc(N2CCCCC2)nc2c1CCCC2.
What is the InChIKey of N-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine?
The InChIKey is QKCCRMLXJJOQRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-2-16-14-12-8-4-5-9-13(12)17-15(18-14)19-10-6-3-7-11-19/h2-11H2,1H3,(H,16,17,18).
What are the key properties of N-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine?
N-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine has a molecular weight of 260.38 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-4-amine is sourced from PubChem (CID 62191304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).