N-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide

C10H17N5O2 — CID 57055464

IUPACN-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide
SMILESCCCCC(=O)N(C)NC(=O)Cn1ccnn1
InChIInChI=1S/C10H17N5O2/c1-3-4-5-10(17)14(2)12-9(16)8-15-7-6-11-13-15/h6-7H,3-5,8H2,1-2H3,(H,12,16)
InChIKeyKASHHMBHMROLIQ-UHFFFAOYSA-N
MW239.28 g/mol
LogP-0.04
Rot. Bonds5

About N-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide

N-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide (PubChem CID 57055464) has the molecular formula C10H17N5O2 and a molecular weight of 239.28 g/mol. Its IUPAC name is N-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide.

Molecular Properties

Compound NameN-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide
PubChem CID57055464
Molecular FormulaC10H17N5O2
Molecular Weight239.28 g/mol
Exact Mass239.14
IUPAC NameN-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide
SMILESCCCCC(=O)N(C)NC(=O)Cn1ccnn1
InChIInChI=1S/C10H17N5O2/c1-3-4-5-10(17)14(2)12-9(16)8-15-7-6-11-13-15/h6-7H,3-5,8H2,1-2H3,(H,12,16)
InChIKeyKASHHMBHMROLIQ-UHFFFAOYSA-N
XLogP-0.04
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

7-(Triazol-1-yl)heptanamide
CID 67729008
N'-[2-(triazol-1-yl)acetyl]pentanehydrazide
CID 91287848
6-Oxo-7-(triazol-1-yl)heptanehydrazide
CID 91591780
2-amino-N-butyl-6-(triazol-1-yl)hexanamide
CID 123760210
2-amino-N-propyl-6-(triazol-1-yl)hexanamide
CID 123899484
(2S,4S)-1-methyl-4-(triazol-1-yl)pyrrolidine-2-carbohydrazide
CID 137415029
2-[2-(Triazol-1-yl)acetyl]pentanehydrazide
CID 141017311
N-methoxy-5-(triazol-1-yl)pentanamide
CID 141119237
N-[2-(triazol-1-yl)acetyl]pentanehydrazide
CID 158623663
N-methyl-6-(triazol-1-yl)hexanamide
CID 164816515
N-methyl-2-[6-(triazol-1-yl)hexylamino]acetamide
CID 169964124
2-(Triazol-1-yl)nonanamide
CID 175895256

Frequently Asked Questions

What is the IUPAC name of N-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide?
The IUPAC name of N-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide (CID 57055464) is N-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide.
What is the SMILES notation for N-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide?
The canonical SMILES for N-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide is CCCCC(=O)N(C)NC(=O)Cn1ccnn1.
What is the InChIKey of N-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide?
The InChIKey is KASHHMBHMROLIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O2/c1-3-4-5-10(17)14(2)12-9(16)8-15-7-6-11-13-15/h6-7H,3-5,8H2,1-2H3,(H,12,16).
What are the key properties of N-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide?
N-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide has a molecular weight of 239.28 g/mol, XLogP of -0.04, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N'-[2-(triazol-1-yl)acetyl]pentanehydrazide is sourced from PubChem (CID 57055464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).