6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine

C16H23N5 — CID 80901927

IUPAC6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine
SMILESCCCc1ccccc1Nc1ncnc(NN)c1C(C)C
InChIInChI=1S/C16H23N5/c1-4-7-12-8-5-6-9-13(12)20-15-14(11(2)3)16(21-17)19-10-18-15/h5-6,8-11H,4,7,17H2,1-3H3,(H2,18,19,20,21)
InChIKeyNJZPCUOKPVUHMD-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.58
Rot. Bonds6

About 6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine

6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine (PubChem CID 80901927) has the molecular formula C16H23N5 and a molecular weight of 285.39 g/mol. Its IUPAC name is 6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine
PubChem CID80901927
Molecular FormulaC16H23N5
Molecular Weight285.39 g/mol
Exact Mass285.20
IUPAC Name6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine
SMILESCCCc1ccccc1Nc1ncnc(NN)c1C(C)C
InChIInChI=1S/C16H23N5/c1-4-7-12-8-5-6-9-13(12)20-15-14(11(2)3)16(21-17)19-10-18-15/h5-6,8-11H,4,7,17H2,1-3H3,(H2,18,19,20,21)
InChIKeyNJZPCUOKPVUHMD-UHFFFAOYSA-N
XLogP3.58
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.58
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

N-(2-chlorophenyl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine
CID 80927804
4-N-[2-(2-methoxyethyl)phenyl]-5-propan-2-ylpyrimidine-4,6-diamine
CID 102908789
6-chloro-N-(2-ethylphenyl)-5-propan-2-ylpyrimidin-4-amine
CID 63735623
6-chloro-4-N-(2-propylphenyl)pyrimidine-4,5-diamine
CID 55143311
6-N-ethyl-5-methyl-4-N-(2-propylphenyl)pyrimidine-4,6-diamine
CID 80807254
4-N-[2-(methoxymethyl)phenyl]-6-N-methyl-5-propan-2-ylpyrimidine-4,6-diamine
CID 80783013
N-(2-chlorophenyl)-6-hydrazinyl-5-propylpyrimidin-4-amine
CID 80927802
N-(5-chloro-2-fluorophenyl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine
CID 80906889
6-hydrazinyl-5-propan-2-yl-N-(4-propan-2-ylphenyl)pyrimidin-4-amine
CID 80912556
1-N-(6-hydrazinyl-5-propylpyrimidin-4-yl)-2-N,2-N-dimethylbenzene-1,2-diamine
CID 106761113
N-(4-bromo-2-methylphenyl)-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine
CID 80921013
6,7-dimethoxy-N-(2-propylphenyl)quinazolin-4-amine
CID 68916243

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine (CID 80901927) is 6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine is CCCc1ccccc1Nc1ncnc(NN)c1C(C)C.
What is the InChIKey of 6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine?
The InChIKey is NJZPCUOKPVUHMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5/c1-4-7-12-8-5-6-9-13(12)20-15-14(11(2)3)16(21-17)19-10-18-15/h5-6,8-11H,4,7,17H2,1-3H3,(H2,18,19,20,21).
What are the key properties of 6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine?
6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine has a molecular weight of 285.39 g/mol, XLogP of 3.58, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine is sourced from PubChem (CID 80901927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).