6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine

C16H23N5 — CID 80901929

IUPAC6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine
SMILESCCCc1c(NN)ncnc1NC(C)c1ccc(C)cc1
InChIInChI=1S/C16H23N5/c1-4-5-14-15(18-10-19-16(14)21-17)20-12(3)13-8-6-11(2)7-9-13/h6-10,12H,4-5,17H2,1-3H3,(H2,18,19,20,21)
InChIKeyNAMFWGBUVMNWEC-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.20
Rot. Bonds6

About 6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine

6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine (PubChem CID 80901929) has the molecular formula C16H23N5 and a molecular weight of 285.39 g/mol. Its IUPAC name is 6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine
PubChem CID80901929
Molecular FormulaC16H23N5
Molecular Weight285.39 g/mol
Exact Mass285.20
IUPAC Name6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine
SMILESCCCc1c(NN)ncnc1NC(C)c1ccc(C)cc1
InChIInChI=1S/C16H23N5/c1-4-5-14-15(18-10-19-16(14)21-17)20-12(3)13-8-6-11(2)7-9-13/h6-10,12H,4-5,17H2,1-3H3,(H2,18,19,20,21)
InChIKeyNAMFWGBUVMNWEC-UHFFFAOYSA-N
XLogP3.20
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 ≤ 53.20
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

6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]-5-propylpyrimidin-4-amine
CID 80897937
5-ethyl-6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyrimidin-4-amine
CID 80924266
N-hexan-2-yl-6-hydrazinyl-5-propylpyrimidin-4-amine
CID 80907974
6-chloro-N-[1-(4-ethylphenyl)ethyl]-5-propylpyrimidin-4-amine
CID 106193555
3-N-(6-hydrazinyl-5-propylpyrimidin-4-yl)-1-N,1-N-dimethylbutane-1,3-diamine
CID 80904538
6-N-methyl-5-propyl-4-N-(1-thiophen-3-ylethyl)pyrimidine-4,6-diamine
CID 80825050
N-(1-cyclohexylethyl)-6-hydrazinyl-5-propylpyrimidin-4-amine
CID 80918571
5-ethyl-6-hydrazinyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine
CID 80918531
N-ethyl-6-hydrazinyl-N-(4-methylphenyl)-5-propylpyrimidin-4-amine
CID 80903906
6-hydrazinyl-N-(3-methoxy-2-methylpropyl)-5-propylpyrimidin-4-amine
CID 80907775
6-hydrazinyl-5-propyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine
CID 80897473
6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-2-propylpyrimidin-4-amine
CID 80942940

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine (CID 80901929) is 6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine is CCCc1c(NN)ncnc1NC(C)c1ccc(C)cc1.
What is the InChIKey of 6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine?
The InChIKey is NAMFWGBUVMNWEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5/c1-4-5-14-15(18-10-19-16(14)21-17)20-12(3)13-8-6-11(2)7-9-13/h6-10,12H,4-5,17H2,1-3H3,(H2,18,19,20,21).
What are the key properties of 6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine?
6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine has a molecular weight of 285.39 g/mol, XLogP of 3.20, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-[1-(4-methylphenyl)ethyl]-5-propylpyrimidin-4-amine is sourced from PubChem (CID 80901929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).