5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine

C10H16BrN5 — CID 80894632

IUPAC5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine
SMILESNNc1ncc(Br)c(NCC2CCCC2)n1
InChIInChI=1S/C10H16BrN5/c11-8-6-14-10(16-12)15-9(8)13-5-7-3-1-2-4-7/h6-7H,1-5,12H2,(H2,13,14,15,16)
InChIKeyJXOUSHDDJMFBCV-UHFFFAOYSA-N
MW286.18 g/mol
LogP2.13
Rot. Bonds4

About 5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine

5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine (PubChem CID 80894632) has the molecular formula C10H16BrN5 and a molecular weight of 286.18 g/mol. Its IUPAC name is 5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine
PubChem CID80894632
Molecular FormulaC10H16BrN5
Molecular Weight286.18 g/mol
Exact Mass285.06
IUPAC Name5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine
SMILESNNc1ncc(Br)c(NCC2CCCC2)n1
InChIInChI=1S/C10H16BrN5/c11-8-6-14-10(16-12)15-9(8)13-5-7-3-1-2-4-7/h6-7H,1-5,12H2,(H2,13,14,15,16)
InChIKeyJXOUSHDDJMFBCV-UHFFFAOYSA-N
XLogP2.13
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.18
LogP ≤ 52.13
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'}

Analyze 5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-bromo-2-hydrazinyl-N-[(4-methylcyclohexyl)methyl]pyrimidin-4-amine
CID 80914415
5-bromo-4-N-(cyclohexylmethyl)pyrimidine-2,4-diamine
CID 80784182
[2-[[(5-bromo-2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 80923968
5-bromo-2-N-butyl-4-N-(cyclohexylmethyl)pyrimidine-2,4-diamine
CID 166723883
5-bromo-2-hydrazinyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-4-amine
CID 106026101
5-bromo-2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine
CID 80922898
5-bromo-4-N-[(4-methylcyclohexyl)methyl]-2-N-propylpyrimidine-2,4-diamine
CID 80828904
5-bromo-2-N-methyl-4-N-[(1-methylpiperidin-3-yl)methyl]pyrimidine-2,4-diamine
CID 80812505
2-[(5-bromo-2-hydrazinylpyrimidin-4-yl)amino]cyclohexan-1-ol
CID 80919191
5-bromo-4-N-(2-cyclopentylethyl)-2-N-ethylpyrimidine-2,4-diamine
CID 80790917
4-[[(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 106138848
5-bromo-N-(cyclobutylmethyl)pyrimidin-4-amine
CID 66341211

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine?
The IUPAC name of 5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine (CID 80894632) is 5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine.
What is the SMILES notation for 5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine?
The canonical SMILES for 5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine is NNc1ncc(Br)c(NCC2CCCC2)n1.
What is the InChIKey of 5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine?
The InChIKey is JXOUSHDDJMFBCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16BrN5/c11-8-6-14-10(16-12)15-9(8)13-5-7-3-1-2-4-7/h6-7H,1-5,12H2,(H2,13,14,15,16).
What are the key properties of 5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine?
5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine has a molecular weight of 286.18 g/mol, XLogP of 2.13, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(cyclopentylmethyl)-2-hydrazinylpyrimidin-4-amine is sourced from PubChem (CID 80894632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).