2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide

C13H16N4O2 — CID 143745283

IUPAC2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide
SMILESCCN(CCO)C(=O)c1nc(N)nc2ccccc12
InChIInChI=1S/C13H16N4O2/c1-2-17(7-8-18)12(19)11-9-5-3-4-6-10(9)15-13(14)16-11/h3-6,18H,2,7-8H2,1H3,(H2,14,15,16)
InChIKeyNNGIIVGLCDVSNE-UHFFFAOYSA-N
MW260.30 g/mol
LogP0.67
Rot. Bonds4

About 2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide

2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide (PubChem CID 143745283) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is 2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide
PubChem CID143745283
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide
SMILESCCN(CCO)C(=O)c1nc(N)nc2ccccc12
InChIInChI=1S/C13H16N4O2/c1-2-17(7-8-18)12(19)11-9-5-3-4-6-10(9)15-13(14)16-11/h3-6,18H,2,7-8H2,1H3,(H2,14,15,16)
InChIKeyNNGIIVGLCDVSNE-UHFFFAOYSA-N
XLogP0.67
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-benzyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide
CID 59483477
2-amino-N,N-dimethylquinazoline-4-carboxamide
CID 25159575
2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide
CID 25160377
N,3,4-triethyl-N-propylquinoline-2-carboxamide
CID 56994978
2-[(2-aminoquinazolin-4-yl)-methylamino]ethanol
CID 80773437
N,N-diethyl-2,4-dimethylquinoline-3-carboxamide
CID 10824990
2-amino-N-benzyl-N-[2-(dimethylamino)ethyl]-6-methylquinazoline-4-carboxamide
CID 59483544
N-ethyl-N-(2-hydroxyethyl)-2-(4-methoxyphenyl)quinoline-4-carboxamide
CID 78796165
2-amino-N,N-diethylquinoline-4-carboxamide
CID 62155871
N-ethyl-N-(2-hydroxyethyl)-5-phenylpyridine-3-carboxamide
CID 109468089
N,N-dipropylacridine-9-carboxamide
CID 170440983
2-[ethyl(2-hydroxyethyl)carbamoyl]benzoic acid
CID 60662044

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide?
The IUPAC name of 2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide (CID 143745283) is 2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide.
What is the SMILES notation for 2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide?
The canonical SMILES for 2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide is CCN(CCO)C(=O)c1nc(N)nc2ccccc12.
What is the InChIKey of 2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide?
The InChIKey is NNGIIVGLCDVSNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-2-17(7-8-18)12(19)11-9-5-3-4-6-10(9)15-13(14)16-11/h3-6,18H,2,7-8H2,1H3,(H2,14,15,16).
What are the key properties of 2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide?
2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide has a molecular weight of 260.30 g/mol, XLogP of 0.67, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-N-(2-hydroxyethyl)quinazoline-4-carboxamide is sourced from PubChem (CID 143745283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).