2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide

C11H19N5O3 — CID 114243633

IUPAC2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide
SMILESCc1cc(C(=O)N(C)CCOCCO)nc(NN)n1
InChIInChI=1S/C11H19N5O3/c1-8-7-9(14-11(13-8)15-12)10(18)16(2)3-5-19-6-4-17/h7,17H,3-6,12H2,1-2H3,(H,13,14,15)
InChIKeyOOGHUDGBARXORB-UHFFFAOYSA-N
MW269.30 g/mol
LogP-0.85
Rot. Bonds7

About 2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide

2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide (PubChem CID 114243633) has the molecular formula C11H19N5O3 and a molecular weight of 269.30 g/mol. Its IUPAC name is 2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide
PubChem CID114243633
Molecular FormulaC11H19N5O3
Molecular Weight269.30 g/mol
Exact Mass269.15
IUPAC Name2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide
SMILESCc1cc(C(=O)N(C)CCOCCO)nc(NN)n1
InChIInChI=1S/C11H19N5O3/c1-8-7-9(14-11(13-8)15-12)10(18)16(2)3-5-19-6-4-17/h7,17H,3-6,12H2,1-2H3,(H,13,14,15)
InChIKeyOOGHUDGBARXORB-UHFFFAOYSA-N
XLogP-0.85
TPSA113.60 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 5-0.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-butyl-N,6-dimethyl-2-(2-methylpropylamino)pyrimidine-4-carboxamide
CID 109320873
N-butyl-2-[2-(4-methoxyphenoxy)ethylamino]-N,6-dimethylpyrimidine-4-carboxamide
CID 109332567
N-(2-cyanopropyl)-N-ethyl-2-hydrazinyl-6-methylpyrimidine-4-carboxamide
CID 114220570
ethyl 2-[[4-[butyl(methyl)carbamoyl]-6-methylpyrimidin-2-yl]amino]benzoate
CID 109333738
N-butyl-2-(3,4-dimethylanilino)-N,6-dimethylpyrimidine-4-carboxamide
CID 109333654
N-butyl-2-(4-ethylanilino)-N,6-dimethylpyrimidine-4-carboxamide
CID 109333659
N-(2-ethoxyethyl)-N-ethyl-2-hydrazinyl-6-methylpyrimidin-4-amine
CID 80909371
2-[2-[(4,6-dimethylpyrimidin-2-yl)amino]ethoxy]ethanol
CID 60732417
N-butyl-N,6-dimethyl-2-(2-phenylethylamino)pyrimidine-4-carboxamide
CID 109330364
N-butyl-N,6-dimethyl-2-(2-propan-2-yloxyanilino)pyrimidine-4-carboxamide
CID 109333690
N-butyl-2-(2,4-dichloroanilino)-N,6-dimethylpyrimidine-4-carboxamide
CID 109333730
2-(3-bromo-4-methylanilino)-N-butyl-N,6-dimethylpyrimidine-4-carboxamide
CID 109333683

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide?
The IUPAC name of 2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide (CID 114243633) is 2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide.
What is the SMILES notation for 2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide?
The canonical SMILES for 2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide is Cc1cc(C(=O)N(C)CCOCCO)nc(NN)n1.
What is the InChIKey of 2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide?
The InChIKey is OOGHUDGBARXORB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O3/c1-8-7-9(14-11(13-8)15-12)10(18)16(2)3-5-19-6-4-17/h7,17H,3-6,12H2,1-2H3,(H,13,14,15).
What are the key properties of 2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide?
2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide has a molecular weight of 269.30 g/mol, XLogP of -0.85, 7 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-[2-(2-hydroxyethoxy)ethyl]-N,6-dimethylpyrimidine-4-carboxamide is sourced from PubChem (CID 114243633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).