[2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol

C11H19N5O — CID 80925618

IUPAC[2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
SMILESNNc1nccc(NCC2CCCC2CO)n1
InChIInChI=1S/C11H19N5O/c12-16-11-13-5-4-10(15-11)14-6-8-2-1-3-9(8)7-17/h4-5,8-9,17H,1-3,6-7,12H2,(H2,13,14,15,16)
InChIKeyNKPAKFCHYBBJAS-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.58
Rot. Bonds5

About [2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol

[2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol (PubChem CID 80925618) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is [2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
PubChem CID80925618
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name[2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
SMILESNNc1nccc(NCC2CCCC2CO)n1
InChIInChI=1S/C11H19N5O/c12-16-11-13-5-4-10(15-11)14-6-8-2-1-3-9(8)7-17/h4-5,8-9,17H,1-3,6-7,12H2,(H2,13,14,15,16)
InChIKeyNKPAKFCHYBBJAS-UHFFFAOYSA-N
XLogP0.58
TPSA96.09 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.58
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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

[2-[[[2-(methylamino)pyrimidin-4-yl]amino]methyl]cyclohexyl]methanol
CID 80856693
[2-[(2-hydrazinylpyrimidin-4-yl)amino]cyclopentyl]methanol
CID 106368360
[2-[[(5-bromo-2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 80923968
2-[[(2-aminopyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 80856454
[2-[[[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]amino]methyl]cyclopentyl]methanol
CID 80925382
2-hydrazinyl-N-[(1-methylpiperidin-3-yl)methyl]pyrimidin-4-amine
CID 80903430
[2-[[(6-amino-2-cyclopropylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 80959887
N-[(1,1-dioxothiolan-3-yl)methyl]-2-hydrazinylpyrimidin-4-amine
CID 80907896
[2-[[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]methyl]cyclopentyl]methanol
CID 106775857
[2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 107874762
[2-[[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 80937943
[2-[[(6-amino-2-methylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 80855981

Frequently Asked Questions

What is the IUPAC name of [2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol?
The IUPAC name of [2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol (CID 80925618) is [2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol?
The canonical SMILES for [2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol is NNc1nccc(NCC2CCCC2CO)n1.
What is the InChIKey of [2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol?
The InChIKey is NKPAKFCHYBBJAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c12-16-11-13-5-4-10(15-11)14-6-8-2-1-3-9(8)7-17/h4-5,8-9,17H,1-3,6-7,12H2,(H2,13,14,15,16).
What are the key properties of [2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol?
[2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol has a molecular weight of 237.31 g/mol, XLogP of 0.58, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol is sourced from PubChem (CID 80925618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).