N-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide

C14H23N5O — CID 102736984

IUPACN-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(Cc2ccnc(NN)c2)CC1
InChIInChI=1S/C14H23N5O/c1-11(20)17-9-12-3-6-19(7-4-12)10-13-2-5-16-14(8-13)18-15/h2,5,8,12H,3-4,6-7,9-10,15H2,1H3,(H,16,18)(H,17,20)
InChIKeyHFASANVNOPBXST-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.72
Rot. Bonds5

About N-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide

N-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide (PubChem CID 102736984) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide
PubChem CID102736984
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC NameN-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(Cc2ccnc(NN)c2)CC1
InChIInChI=1S/C14H23N5O/c1-11(20)17-9-12-3-6-19(7-4-12)10-13-2-5-16-14(8-13)18-15/h2,5,8,12H,3-4,6-7,9-10,15H2,1H3,(H,16,18)(H,17,20)
InChIKeyHFASANVNOPBXST-UHFFFAOYSA-N
XLogP0.72
TPSA83.28 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

[4-[[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]methyl]-2-pyridinyl]hydrazine
CID 63008284
[4-[(4-methylazepan-1-yl)methyl]-2-pyridinyl]hydrazine
CID 63624320
[4-[(4-cyclopropylpiperazin-1-yl)methyl]-2-pyridinyl]hydrazine
CID 62470104
N-[[1-[(3-bromo-5-fluorophenyl)methyl]piperidin-4-yl]methyl]acetamide
CID 103728195
[4-(thiomorpholin-4-ylmethyl)-2-pyridinyl]hydrazine
CID 62472279
[4-[(3-ethylpiperidin-1-yl)methyl]-2-pyridinyl]hydrazine
CID 62472214
[4-[(4,4-dimethylazepan-1-yl)methyl]-2-pyridinyl]hydrazine
CID 65281763
N-[[1-[(2-cyclohexylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]acetamide
CID 70737977
2-[4-[(2-hydrazinyl-4-pyridinyl)methyl]-1,4-diazepan-1-yl]ethanol
CID 107226403
N-[[1-[(3-amino-2-methylphenyl)methyl]piperidin-4-yl]methyl]acetamide
CID 102736075
N-[[1-[(5-amino-2-hydroxyphenyl)methyl]piperidin-4-yl]methyl]acetamide
CID 102736031
2-[4-(acetamidomethyl)piperidin-1-yl]pyridine-4-carboxamide
CID 72916320

Frequently Asked Questions

What is the IUPAC name of N-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide?
The IUPAC name of N-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide (CID 102736984) is N-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide.
What is the SMILES notation for N-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide?
The canonical SMILES for N-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide is CC(=O)NCC1CCN(Cc2ccnc(NN)c2)CC1.
What is the InChIKey of N-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide?
The InChIKey is HFASANVNOPBXST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-11(20)17-9-12-3-6-19(7-4-12)10-13-2-5-16-14(8-13)18-15/h2,5,8,12H,3-4,6-7,9-10,15H2,1H3,(H,16,18)(H,17,20).
What are the key properties of N-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide?
N-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide has a molecular weight of 277.37 g/mol, XLogP of 0.72, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[(2-hydrazinyl-4-pyridinyl)methyl]piperidin-4-yl]methyl]acetamide is sourced from PubChem (CID 102736984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).