2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride

C15H23ClN4O2 — CID 119338335

IUPAC2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride
SMILESCCCC(N)C(=O)Nc1cccc(N2CCCNC2=O)c1.Cl
InChIInChI=1S/C15H22N4O2.ClH/c1-2-5-13(16)14(20)18-11-6-3-7-12(10-11)19-9-4-8-17-15(19)21;/h3,6-7,10,13H,2,4-5,8-9,16H2,1H3,(H,17,21)(H,18,20);1H
InChIKeyUHIVLILXKSGUDM-UHFFFAOYSA-N
MW326.83 g/mol
LogP2.09
Rot. Bonds5

About 2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride

2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride (PubChem CID 119338335) has the molecular formula C15H23ClN4O2 and a molecular weight of 326.83 g/mol. Its IUPAC name is 2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride
PubChem CID119338335
Molecular FormulaC15H23ClN4O2
Molecular Weight326.83 g/mol
Exact Mass326.15
IUPAC Name2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride
SMILESCCCC(N)C(=O)Nc1cccc(N2CCCNC2=O)c1.Cl
InChIInChI=1S/C15H22N4O2.ClH/c1-2-5-13(16)14(20)18-11-6-3-7-12(10-11)19-9-4-8-17-15(19)21;/h3,6-7,10,13H,2,4-5,8-9,16H2,1H3,(H,17,21)(H,18,20);1H
InChIKeyUHIVLILXKSGUDM-UHFFFAOYSA-N
XLogP2.09
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.83
LogP ≤ 52.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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2-amino-2-(oxan-4-yl)-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]acetamide
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(2R)-2-methoxy-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]-2-phenylacetamide
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1-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]cyclopropane-1-carboxamide
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2-bromo-N-[3-(2-oxoimidazolidin-1-yl)phenyl]propanamide
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(2S)-2-(2-methylpropoxy)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]propanamide
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(2S)-2-amino-N-[4-(2-oxoimidazolidin-1-yl)phenyl]butanamide;hydrochloride
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2-amino-N-(3-ethylphenyl)pentanamide;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride (CID 119338335) is 2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride is CCCC(N)C(=O)Nc1cccc(N2CCCNC2=O)c1.Cl.
What is the InChIKey of 2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride?
The InChIKey is UHIVLILXKSGUDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2.ClH/c1-2-5-13(16)14(20)18-11-6-3-7-12(10-11)19-9-4-8-17-15(19)21;/h3,6-7,10,13H,2,4-5,8-9,16H2,1H3,(H,17,21)(H,18,20);1H.
What are the key properties of 2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride?
2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride has a molecular weight of 326.83 g/mol, XLogP of 2.09, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride is sourced from PubChem (CID 119338335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).