6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine

C14H19N5 — CID 80930265

IUPAC6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine
SMILESCc1ccccc1CCNc1ncnc(NN)c1C
InChIInChI=1S/C14H19N5/c1-10-5-3-4-6-12(10)7-8-16-13-11(2)14(19-15)18-9-17-13/h3-6,9H,7-8,15H2,1-2H3,(H2,16,17,18,19)
InChIKeyCWYVXIHGETWPBT-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.03
Rot. Bonds5

About 6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine

6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine (PubChem CID 80930265) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is 6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine
PubChem CID80930265
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC Name6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine
SMILESCc1ccccc1CCNc1ncnc(NN)c1C
InChIInChI=1S/C14H19N5/c1-10-5-3-4-6-12(10)7-8-16-13-11(2)14(19-15)18-9-17-13/h3-6,9H,7-8,15H2,1-2H3,(H2,16,17,18,19)
InChIKeyCWYVXIHGETWPBT-UHFFFAOYSA-N
XLogP2.03
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.03
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-5-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
CID 80932540
5-bromo-4-N-[2-(2-methylphenyl)ethyl]pyrimidine-4,6-diamine
CID 114072528
4-[2-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethyl]phenol
CID 80898704
5-chloro-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine
CID 105369517
6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine
CID 80902524
6-N-ethyl-2,5-dimethyl-4-N-[2-(2-methylphenyl)ethyl]pyrimidine-4,6-diamine
CID 80836692
4-chloro-6-[2-(2-methylphenyl)ethylamino]pyrimidine-5-carbaldehyde
CID 79756018
3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propan-1-ol
CID 80943609
5-bromo-6-hydrazinyl-N-[2-(2-methoxyphenyl)ethyl]pyrimidin-4-amine
CID 106262742
4-[2-(2-methylphenyl)ethylamino]pyrimidine-5-carboxylic acid
CID 115148987
5-amino-6-[2-(2-methylphenyl)ethylamino]pyridine-3-carbonitrile
CID 103468756
3,5-dibromo-N-[2-(2-methylphenyl)ethyl]pyridin-2-amine
CID 113413714

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine (CID 80930265) is 6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine is Cc1ccccc1CCNc1ncnc(NN)c1C.
What is the InChIKey of 6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine?
The InChIKey is CWYVXIHGETWPBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-10-5-3-4-6-12(10)7-8-16-13-11(2)14(19-15)18-9-17-13/h3-6,9H,7-8,15H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine?
6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine has a molecular weight of 257.34 g/mol, XLogP of 2.03, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-5-methyl-N-[2-(2-methylphenyl)ethyl]pyrimidin-4-amine is sourced from PubChem (CID 80930265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).