N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide

C16H20N4O2 — CID 110436254

IUPACN-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide
SMILESO=C(NCCO)C1CCCN(c2ncnc3ccccc23)C1
InChIInChI=1S/C16H20N4O2/c21-9-7-17-16(22)12-4-3-8-20(10-12)15-13-5-1-2-6-14(13)18-11-19-15/h1-2,5-6,11-12,21H,3-4,7-10H2,(H,17,22)
InChIKeyCUFFJBKAJVHMOQ-UHFFFAOYSA-N
MW300.36 g/mol
LogP0.95
Rot. Bonds4

About N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide

N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide (PubChem CID 110436254) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide
PubChem CID110436254
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC NameN-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide
SMILESO=C(NCCO)C1CCCN(c2ncnc3ccccc23)C1
InChIInChI=1S/C16H20N4O2/c21-9-7-17-16(22)12-4-3-8-20(10-12)15-13-5-1-2-6-14(13)18-11-19-15/h1-2,5-6,11-12,21H,3-4,7-10H2,(H,17,22)
InChIKeyCUFFJBKAJVHMOQ-UHFFFAOYSA-N
XLogP0.95
TPSA78.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-butyl-1-quinazolin-4-ylpiperidine-3-carboxamide
CID 49431629
N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-4-carboxamide
CID 47807499
1-quinazolin-4-yl-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 133326896
N-(3-formamidopropyl)-1-quinazolin-4-ylpiperidine-3-carboxamide
CID 110436261
(3S)-1-quinazolin-4-ylpiperidine-3-carboxamide
CID 94184844
N-butyl-1-(6-methylquinazolin-4-yl)piperidine-3-carboxamide
CID 133278233
(3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide
CID 96566820
4-(3-chloropiperidin-1-yl)quinazoline
CID 55184238
N-[(1-quinazolin-4-ylpiperidin-3-yl)methyl]ethanamine
CID 62593559
N-(3-aminobutyl)-1-thieno[2,3-d]pyrimidin-4-ylpiperidine-3-carboxamide;hydrochloride
CID 119499104
4-(azepan-1-yl)quinazoline
CID 5207391
1-(7-aminoquinazolin-4-yl)-N-methylpiperidine-3-carboxamide
CID 103194356

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide (CID 110436254) is N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide is O=C(NCCO)C1CCCN(c2ncnc3ccccc23)C1.
What is the InChIKey of N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide?
The InChIKey is CUFFJBKAJVHMOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c21-9-7-17-16(22)12-4-3-8-20(10-12)15-13-5-1-2-6-14(13)18-11-19-15/h1-2,5-6,11-12,21H,3-4,7-10H2,(H,17,22).
What are the key properties of N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide?
N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 0.95, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide is sourced from PubChem (CID 110436254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).