N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine

C13H23N5 — CID 80906631

IUPACN-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1c(NN)ncnc1N(C)C(C)C1CC1
InChIInChI=1S/C13H23N5/c1-8(2)11-12(17-14)15-7-16-13(11)18(4)9(3)10-5-6-10/h7-10H,5-6,14H2,1-4H3,(H,15,16,17)
InChIKeyQJZARQVGVOUYTD-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.12
Rot. Bonds5

About N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine

N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine (PubChem CID 80906631) has the molecular formula C13H23N5 and a molecular weight of 249.36 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine
PubChem CID80906631
Molecular FormulaC13H23N5
Molecular Weight249.36 g/mol
Exact Mass249.20
IUPAC NameN-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1c(NN)ncnc1N(C)C(C)C1CC1
InChIInChI=1S/C13H23N5/c1-8(2)11-12(17-14)15-7-16-13(11)18(4)9(3)10-5-6-10/h7-10H,5-6,14H2,1-4H3,(H,15,16,17)
InChIKeyQJZARQVGVOUYTD-UHFFFAOYSA-N
XLogP2.12
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.12
H-Bond Donors ≤ 52
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-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine
CID 80906264
N-(cyclopropylmethyl)-N-ethyl-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine
CID 80913297
6-hydrazinyl-N,N-bis(2-methylpropyl)-5-propan-2-ylpyrimidin-4-amine
CID 80898611
4-N-(1-cyclopropylethyl)-4-N-methyl-6-N,5-dipropylpyrimidine-4,6-diamine
CID 80792671
6-hydrazinyl-N-methyl-N-(1-methylpiperidin-3-yl)-5-propan-2-ylpyrimidin-4-amine
CID 80919618
6-hydrazinyl-N-methyl-5-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine
CID 80899159
2-(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)-1,1-dimethylhydrazine
CID 83027639
2-[cyclopentyl-(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]acetamide
CID 80900043
N'-(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 80901295
2-[ethyl-(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]ethanol
CID 80899078
N-tert-butyl-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine
CID 80930410
6-hydrazinyl-N-methyl-5-propan-2-yl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
CID 80911233

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine?
The IUPAC name of N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine (CID 80906631) is N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine is CC(C)c1c(NN)ncnc1N(C)C(C)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine?
The InChIKey is QJZARQVGVOUYTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5/c1-8(2)11-12(17-14)15-7-16-13(11)18(4)9(3)10-5-6-10/h7-10H,5-6,14H2,1-4H3,(H,15,16,17).
What are the key properties of N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine?
N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 2.12, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 80906631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).