N-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide

C11H20N8O — CID 80906845

IUPACN-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide
SMILESCCNC(=O)CNc1nc(NN)nc(N2CCCC2)n1
InChIInChI=1S/C11H20N8O/c1-2-13-8(20)7-14-9-15-10(18-12)17-11(16-9)19-5-3-4-6-19/h2-7,12H2,1H3,(H,13,20)(H2,14,15,16,17,18)
InChIKeyORIWKYMPHLDXJQ-UHFFFAOYSA-N
MW280.34 g/mol
LogP-0.69
Rot. Bonds6

About N-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide

N-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide (PubChem CID 80906845) has the molecular formula C11H20N8O and a molecular weight of 280.34 g/mol. Its IUPAC name is N-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide
PubChem CID80906845
Molecular FormulaC11H20N8O
Molecular Weight280.34 g/mol
Exact Mass280.18
IUPAC NameN-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide
SMILESCCNC(=O)CNc1nc(NN)nc(N2CCCC2)n1
InChIInChI=1S/C11H20N8O/c1-2-13-8(20)7-14-9-15-10(18-12)17-11(16-9)19-5-3-4-6-19/h2-7,12H2,1H3,(H,13,20)(H2,14,15,16,17,18)
InChIKeyORIWKYMPHLDXJQ-UHFFFAOYSA-N
XLogP-0.69
TPSA121.09 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 5-0.69
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-4-hydrazinyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80932196
2-[(4-amino-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]-N-methylacetamide
CID 80784562
2-[(4-chloro-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]-N-ethylacetamide
CID 62863353
2-[(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-N-methylacetamide
CID 80783513
3-[(4-hydrazinyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-2-methylpropan-1-ol
CID 80915279
N-ethyl-2-[(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)amino]acetamide
CID 80906622
N-(2,2-dimethylpropyl)-4-hydrazinyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80899003
N-[2-[[4-(ethylamino)-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl]amino]ethyl]acetamide
CID 80775624
3-[[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]methyl]pentan-1-ol
CID 80929099
2-[(4-hydrazinyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]ethyl carbamate
CID 83206301
N-cyclopropyl-2-[[4-(methylamino)-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl]amino]acetamide
CID 80775829
3-[(4-hydrazinyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]propan-1-ol
CID 80942778

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide?
The IUPAC name of N-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide (CID 80906845) is N-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide.
What is the SMILES notation for N-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide?
The canonical SMILES for N-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide is CCNC(=O)CNc1nc(NN)nc(N2CCCC2)n1.
What is the InChIKey of N-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide?
The InChIKey is ORIWKYMPHLDXJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N8O/c1-2-13-8(20)7-14-9-15-10(18-12)17-11(16-9)19-5-3-4-6-19/h2-7,12H2,1H3,(H,13,20)(H2,14,15,16,17,18).
What are the key properties of N-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide?
N-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide has a molecular weight of 280.34 g/mol, XLogP of -0.69, 6 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(4-hydrazinyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]acetamide is sourced from PubChem (CID 80906845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).