6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine

C16H17N5 — CID 80902524

IUPAC6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine
SMILESCc1c(NN)ncnc1NCc1cccc2ccccc12
InChIInChI=1S/C16H17N5/c1-11-15(19-10-20-16(11)21-17)18-9-13-7-4-6-12-5-2-3-8-14(12)13/h2-8,10H,9,17H2,1H3,(H2,18,19,20,21)
InChIKeyCGQUVYMIXDGLEE-UHFFFAOYSA-N
MW279.35 g/mol
LogP2.84
Rot. Bonds4

About 6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine

6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine (PubChem CID 80902524) has the molecular formula C16H17N5 and a molecular weight of 279.35 g/mol. Its IUPAC name is 6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine
PubChem CID80902524
Molecular FormulaC16H17N5
Molecular Weight279.35 g/mol
Exact Mass279.15
IUPAC Name6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine
SMILESCc1c(NN)ncnc1NCc1cccc2ccccc12
InChIInChI=1S/C16H17N5/c1-11-15(19-10-20-16(11)21-17)18-9-13-7-4-6-12-5-2-3-8-14(12)13/h2-8,10H,9,17H2,1H3,(H2,18,19,20,21)
InChIKeyCGQUVYMIXDGLEE-UHFFFAOYSA-N
XLogP2.84
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.35
LogP ≤ 52.84
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-(2-methylphenyl)ethyl]pyrimidin-4-amine
CID 80930265
6-N,5-dimethyl-4-N-(quinolin-8-ylmethyl)pyrimidine-4,6-diamine
CID 81435677
3-bromo-5-methyl-N-(naphthalen-1-ylmethyl)pyridin-2-amine
CID 105366894
6-N-ethyl-5-methyl-4-N-naphthalen-1-ylpyrimidine-4,6-diamine
CID 80768828
6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)pyrimidin-4-amine
CID 106424788
2-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine
CID 55112812
1-methyl-3-N-(naphthalen-1-ylmethyl)pyrazole-3,4-diamine
CID 103078409
6-hydrazinyl-5-methyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
CID 80932540
2-methyl-N-(naphthalen-1-ylmethyl)aniline
CID 28524236
naphthalen-1-ylmethylhydrazine;hydrochloride
CID 71656108
N-(naphthalen-1-ylmethyl)-6-propan-2-ylpyrimidin-4-amine
CID 62368631
3-bromo-2-N-(naphthalen-1-ylmethyl)pyridine-2,5-diamine
CID 79535450

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine (CID 80902524) is 6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine is Cc1c(NN)ncnc1NCc1cccc2ccccc12.
What is the InChIKey of 6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine?
The InChIKey is CGQUVYMIXDGLEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5/c1-11-15(19-10-20-16(11)21-17)18-9-13-7-4-6-12-5-2-3-8-14(12)13/h2-8,10H,9,17H2,1H3,(H2,18,19,20,21).
What are the key properties of 6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine?
6-hydrazinyl-5-methyl-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine has a molecular weight of 279.35 g/mol, XLogP of 2.84, 4 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-(naphthalen-1-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 80902524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).