N-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide

C19H28N4O — CID 110237962

IUPACN-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide
SMILESO=C(NC1CCCc2nc(N3CCCCC3)ncc21)C1CCCC1
InChIInChI=1S/C19H28N4O/c24-18(14-7-2-3-8-14)21-16-9-6-10-17-15(16)13-20-19(22-17)23-11-4-1-5-12-23/h13-14,16H,1-12H2,(H,21,24)
InChIKeyJGLCMKZOKZHETM-UHFFFAOYSA-N
MW328.46 g/mol
LogP3.15
Rot. Bonds3

About N-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide

N-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide (PubChem CID 110237962) has the molecular formula C19H28N4O and a molecular weight of 328.46 g/mol. Its IUPAC name is N-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide
PubChem CID110237962
Molecular FormulaC19H28N4O
Molecular Weight328.46 g/mol
Exact Mass328.23
IUPAC NameN-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide
SMILESO=C(NC1CCCc2nc(N3CCCCC3)ncc21)C1CCCC1
InChIInChI=1S/C19H28N4O/c24-18(14-7-2-3-8-14)21-16-9-6-10-17-15(16)13-20-19(22-17)23-11-4-1-5-12-23/h13-14,16H,1-12H2,(H,21,24)
InChIKeyJGLCMKZOKZHETM-UHFFFAOYSA-N
XLogP3.15
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.46
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide?
The IUPAC name of N-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide (CID 110237962) is N-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide.
What is the SMILES notation for N-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide?
The canonical SMILES for N-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide is O=C(NC1CCCc2nc(N3CCCCC3)ncc21)C1CCCC1.
What is the InChIKey of N-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide?
The InChIKey is JGLCMKZOKZHETM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O/c24-18(14-7-2-3-8-14)21-16-9-6-10-17-15(16)13-20-19(22-17)23-11-4-1-5-12-23/h13-14,16H,1-12H2,(H,21,24).
What are the key properties of N-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide?
N-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide has a molecular weight of 328.46 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-1-yl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide is sourced from PubChem (CID 110237962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).