1-quinazolin-2-ylpiperazine-2-carboxamide

C13H15N5O — CID 114789482

IUPAC1-quinazolin-2-ylpiperazine-2-carboxamide
SMILESNC(=O)C1CNCCN1c1ncc2ccccc2n1
InChIInChI=1S/C13H15N5O/c14-12(19)11-8-15-5-6-18(11)13-16-7-9-3-1-2-4-10(9)17-13/h1-4,7,11,15H,5-6,8H2,(H2,14,19)
InChIKeyZTVZGFAIOLFGAH-UHFFFAOYSA-N
MW257.30 g/mol
LogP-0.11
Rot. Bonds2

About 1-quinazolin-2-ylpiperazine-2-carboxamide

1-quinazolin-2-ylpiperazine-2-carboxamide (PubChem CID 114789482) has the molecular formula C13H15N5O and a molecular weight of 257.30 g/mol. Its IUPAC name is 1-quinazolin-2-ylpiperazine-2-carboxamide.

Molecular Properties

Compound Name1-quinazolin-2-ylpiperazine-2-carboxamide
PubChem CID114789482
Molecular FormulaC13H15N5O
Molecular Weight257.30 g/mol
Exact Mass257.13
IUPAC Name1-quinazolin-2-ylpiperazine-2-carboxamide
SMILESNC(=O)C1CNCCN1c1ncc2ccccc2n1
InChIInChI=1S/C13H15N5O/c14-12(19)11-8-15-5-6-18(11)13-16-7-9-3-1-2-4-10(9)17-13/h1-4,7,11,15H,5-6,8H2,(H2,14,19)
InChIKeyZTVZGFAIOLFGAH-UHFFFAOYSA-N
XLogP-0.11
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.30
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazine-2-carboxamide
CID 114787140
1-(2,3-dihydro-1H-indene-2-carbonyl)piperazine-2-carboxamide
CID 106893368
methyl 1-quinazolin-2-ylpiperidine-2-carboxylate
CID 114789710
2-(3-oxo-1-quinazolin-2-ylpiperazin-2-yl)acetic acid
CID 114788579
(2S)-1-(4-chloropyrimidin-2-yl)piperazine-2-carboxylic acid
CID 97166480
4-ethyl-1-quinazolin-2-ylpiperidine-2-carboxylic acid
CID 114788663
1-(7-hydroxyisoquinolin-1-yl)piperazine-2-carboxamide
CID 106540772
(1-quinazolin-2-ylazetidin-3-yl)methanamine
CID 114789950
1-(6-fluoro-1H-benzimidazol-2-yl)piperazine-2-carboxamide
CID 103295287
(2R)-1-(3-ethoxyquinoxalin-2-yl)piperazine-2-carboxylic acid
CID 97163463
1-(4-methylpyrimidin-2-yl)piperazine-2-carboxylic acid;hydrochloride
CID 71639214
(2R)-1-(1,3-benzoxazol-2-yl)piperazine-2-carboxylic acid
CID 97055425

Frequently Asked Questions

What is the IUPAC name of 1-quinazolin-2-ylpiperazine-2-carboxamide?
The IUPAC name of 1-quinazolin-2-ylpiperazine-2-carboxamide (CID 114789482) is 1-quinazolin-2-ylpiperazine-2-carboxamide.
What is the SMILES notation for 1-quinazolin-2-ylpiperazine-2-carboxamide?
The canonical SMILES for 1-quinazolin-2-ylpiperazine-2-carboxamide is NC(=O)C1CNCCN1c1ncc2ccccc2n1.
What is the InChIKey of 1-quinazolin-2-ylpiperazine-2-carboxamide?
The InChIKey is ZTVZGFAIOLFGAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O/c14-12(19)11-8-15-5-6-18(11)13-16-7-9-3-1-2-4-10(9)17-13/h1-4,7,11,15H,5-6,8H2,(H2,14,19).
What are the key properties of 1-quinazolin-2-ylpiperazine-2-carboxamide?
1-quinazolin-2-ylpiperazine-2-carboxamide has a molecular weight of 257.30 g/mol, XLogP of -0.11, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-quinazolin-2-ylpiperazine-2-carboxamide is sourced from PubChem (CID 114789482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).