6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine

C15H28N6 — CID 80900343

IUPAC6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1c(NN)ncnc1NCC(C)N1CCCCC1
InChIInChI=1S/C15H28N6/c1-11(2)13-14(18-10-19-15(13)20-16)17-9-12(3)21-7-5-4-6-8-21/h10-12H,4-9,16H2,1-3H3,(H2,17,18,19,20)
InChIKeyTVGROHMEBAFRPE-UHFFFAOYSA-N
MW292.43 g/mol
LogP2.17
Rot. Bonds6

About 6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine

6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine (PubChem CID 80900343) has the molecular formula C15H28N6 and a molecular weight of 292.43 g/mol. Its IUPAC name is 6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine
PubChem CID80900343
Molecular FormulaC15H28N6
Molecular Weight292.43 g/mol
Exact Mass292.24
IUPAC Name6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1c(NN)ncnc1NCC(C)N1CCCCC1
InChIInChI=1S/C15H28N6/c1-11(2)13-14(18-10-19-15(13)20-16)17-9-12(3)21-7-5-4-6-8-21/h10-12H,4-9,16H2,1-3H3,(H2,17,18,19,20)
InChIKeyTVGROHMEBAFRPE-UHFFFAOYSA-N
XLogP2.17
TPSA79.10 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.17
H-Bond Donors ≤ 53
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

4-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidine-4,6-diamine
CID 80814271
4-N-(2-piperidin-1-ylpropyl)-5-propylpyrimidine-4,6-diamine
CID 80818981
6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine
CID 102701988
6-hydrazinyl-N-[(1-methylpyrrolidin-2-yl)methyl]-5-propan-2-ylpyrimidin-4-amine
CID 114138405
1-[(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]-4-methylpentan-2-ol
CID 107159905
6-hydrazinyl-N-[(1-methylpiperidin-4-yl)methyl]-5-propan-2-ylpyrimidin-4-amine
CID 80902596
6-ethyl-5-fluoro-N-(2-pyrrolidin-1-ylpropyl)pyrimidin-4-amine
CID 103879827
N-tert-butyl-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine
CID 80930410
6-hydrazinyl-N,5-di(propan-2-yl)pyrimidin-4-amine
CID 80932454
N-(2-pyrrolidin-1-ylpropyl)thieno[2,3-d]pyrimidin-4-amine
CID 113222136
2-[[(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 80915508
2-[[(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 80924426

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine (CID 80900343) is 6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine is CC(C)c1c(NN)ncnc1NCC(C)N1CCCCC1.
What is the InChIKey of 6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine?
The InChIKey is TVGROHMEBAFRPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N6/c1-11(2)13-14(18-10-19-15(13)20-16)17-9-12(3)21-7-5-4-6-8-21/h10-12H,4-9,16H2,1-3H3,(H2,17,18,19,20).
What are the key properties of 6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine?
6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine has a molecular weight of 292.43 g/mol, XLogP of 2.17, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 80900343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).