4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine

C17H24N6 — CID 19140445

IUPAC4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine
SMILESCCC1CCCCN1c1ncnc(NNc2ccccc2)c1N
InChIInChI=1S/C17H24N6/c1-2-14-10-6-7-11-23(14)17-15(18)16(19-12-20-17)22-21-13-8-4-3-5-9-13/h3-5,8-9,12,14,21H,2,6-7,10-11,18H2,1H3,(H,19,20,22)
InChIKeyWYAWRINGIKQOLQ-UHFFFAOYSA-N
MW312.42 g/mol
LogP3.27
Rot. Bonds5

About 4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine

4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine (PubChem CID 19140445) has the molecular formula C17H24N6 and a molecular weight of 312.42 g/mol. Its IUPAC name is 4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine.

Molecular Properties

Compound Name4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine
PubChem CID19140445
Molecular FormulaC17H24N6
Molecular Weight312.42 g/mol
Exact Mass312.21
IUPAC Name4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine
SMILESCCC1CCCCN1c1ncnc(NNc2ccccc2)c1N
InChIInChI=1S/C17H24N6/c1-2-14-10-6-7-11-23(14)17-15(18)16(19-12-20-17)22-21-13-8-4-3-5-9-13/h3-5,8-9,12,14,21H,2,6-7,10-11,18H2,1H3,(H,19,20,22)
InChIKeyWYAWRINGIKQOLQ-UHFFFAOYSA-N
XLogP3.27
TPSA79.10 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 53.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

6-(2-ethylpiperidin-1-yl)-4-N-(4-phenoxyphenyl)pyrimidine-4,5-diamine
CID 19140566
4-N-(3,4-dimethylphenyl)-6-(2-ethylpiperidin-1-yl)pyrimidine-4,5-diamine
CID 22546179
N'-[5-amino-6-(2-ethylpiperidin-1-yl)pyrimidin-4-yl]pyridine-4-carbohydrazide
CID 19140515
N'-[5-amino-6-(2-ethylpiperidin-1-yl)pyrimidin-4-yl]-4-fluorobenzohydrazide
CID 19140506
6-(2-ethylpiperidin-1-yl)-4-N-(5-methyl-2-pyridinyl)pyrimidine-4,5-diamine
CID 19140543
6-(2-ethylpiperidin-1-yl)-4-N-(1,3-thiazol-2-yl)pyrimidine-4,5-diamine
CID 19140470
4-(2-ethylpiperidin-1-yl)-6-(2-methoxyphenoxy)pyrimidin-5-amine
CID 19140576
4-N,4-N-diethyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4,5-diamine
CID 19136715
4-N-benzyl-6-(2-ethylpiperidin-1-yl)-4-N-pyridin-2-ylpyrimidine-4,5-diamine
CID 19140544
4-N-(1,3-benzodioxol-5-ylmethyl)-6-(2-ethylpiperidin-1-yl)pyrimidine-4,5-diamine
CID 22542524
4-N-[2-(cyclohexen-1-yl)ethyl]-6-(2-ethylpiperidin-1-yl)pyrimidine-4,5-diamine
CID 19140440
6-(2-ethylpiperidin-1-yl)-5-nitro-N-(1-phenylethyl)pyrimidin-4-amine
CID 23492438

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine?
The IUPAC name of 4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine (CID 19140445) is 4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine.
What is the SMILES notation for 4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine?
The canonical SMILES for 4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine is CCC1CCCCN1c1ncnc(NNc2ccccc2)c1N.
What is the InChIKey of 4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine?
The InChIKey is WYAWRINGIKQOLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6/c1-2-14-10-6-7-11-23(14)17-15(18)16(19-12-20-17)22-21-13-8-4-3-5-9-13/h3-5,8-9,12,14,21H,2,6-7,10-11,18H2,1H3,(H,19,20,22).
What are the key properties of 4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine?
4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine has a molecular weight of 312.42 g/mol, XLogP of 3.27, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylpiperidin-1-yl)-6-(2-phenylhydrazinyl)pyrimidin-5-amine is sourced from PubChem (CID 19140445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).