6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine

C14H19N5O — CID 80947745

IUPAC6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(NN)cc(Nc2ccc(OC)cc2)n1
InChIInChI=1S/C14H19N5O/c1-3-4-12-17-13(9-14(18-12)19-15)16-10-5-7-11(20-2)8-6-10/h5-9H,3-4,15H2,1-2H3,(H2,16,17,18,19)
InChIKeyJWTLMPJLGUEXMD-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.47
Rot. Bonds6

About 6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine

6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine (PubChem CID 80947745) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine
PubChem CID80947745
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(NN)cc(Nc2ccc(OC)cc2)n1
InChIInChI=1S/C14H19N5O/c1-3-4-12-17-13(9-14(18-12)19-15)16-10-5-7-11(20-2)8-6-10/h5-9H,3-4,15H2,1-2H3,(H2,16,17,18,19)
InChIKeyJWTLMPJLGUEXMD-UHFFFAOYSA-N
XLogP2.47
TPSA85.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.47
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

6-hydrazinyl-N-(3-methoxyphenyl)-2-propylpyrimidin-4-amine
CID 80947184
4-N-(4-methoxyphenyl)-2-propylpyrimidine-4,6-diamine
CID 80946490
N-(3-ethylphenyl)-6-hydrazinyl-2-propylpyrimidin-4-amine
CID 80947085
2-ethyl-4-N-(4-methoxyphenyl)-6-N-methylpyrimidine-4,6-diamine
CID 80933993
4-N-(4-propoxyphenyl)-2-propylpyrimidine-4,6-diamine
CID 80941469
N-(2,6-difluorophenyl)-6-hydrazinyl-2-propylpyrimidin-4-amine
CID 80946886
4-ethyl-6-hydrazinyl-N-(4-methoxyphenyl)pyrimidin-2-amine
CID 94672765
6-hydrazinyl-2-propylpyrimidin-4-amine
CID 80947336
[6-(4-bromophenoxy)-2-propylpyrimidin-4-yl]hydrazine
CID 80947208
4-N-(4-methoxy-2-methylphenyl)-2-propylpyrimidine-4,6-diamine
CID 80954632
4-N-(2-bromo-5-methoxyphenyl)-6-N-methyl-2-propylpyrimidine-4,6-diamine
CID 80944386
(6-ethoxy-2-propylpyrimidin-4-yl)hydrazine
CID 80947198

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine (CID 80947745) is 6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine is CCCc1nc(NN)cc(Nc2ccc(OC)cc2)n1.
What is the InChIKey of 6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine?
The InChIKey is JWTLMPJLGUEXMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-3-4-12-17-13(9-14(18-12)19-15)16-10-5-7-11(20-2)8-6-10/h5-9H,3-4,15H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine?
6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine has a molecular weight of 273.34 g/mol, XLogP of 2.47, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(4-methoxyphenyl)-2-propylpyrimidin-4-amine is sourced from PubChem (CID 80947745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).