6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine

C14H23N7 — CID 106106901

IUPAC6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine
SMILESCc1c(NN)nc(C(C)C)nc1NCCc1ccn(C)n1
InChIInChI=1S/C14H23N7/c1-9(2)12-17-13(10(3)14(18-12)19-15)16-7-5-11-6-8-21(4)20-11/h6,8-9H,5,7,15H2,1-4H3,(H2,16,17,18,19)
InChIKeyOHUXYKSIGKKPRA-UHFFFAOYSA-N
MW289.39 g/mol
LogP1.58
Rot. Bonds6

About 6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine

6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine (PubChem CID 106106901) has the molecular formula C14H23N7 and a molecular weight of 289.39 g/mol. Its IUPAC name is 6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine
PubChem CID106106901
Molecular FormulaC14H23N7
Molecular Weight289.39 g/mol
Exact Mass289.20
IUPAC Name6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine
SMILESCc1c(NN)nc(C(C)C)nc1NCCc1ccn(C)n1
InChIInChI=1S/C14H23N7/c1-9(2)12-17-13(10(3)14(18-12)19-15)16-7-5-11-6-8-21(4)20-11/h6,8-9H,5,7,15H2,1-4H3,(H2,16,17,18,19)
InChIKeyOHUXYKSIGKKPRA-UHFFFAOYSA-N
XLogP1.58
TPSA93.68 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.39
LogP ≤ 51.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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-N-ethyl-5-methyl-4-N-[(1-methylpyrazol-3-yl)methyl]-2-propan-2-ylpyrimidine-4,6-diamine
CID 82873932
6-N,2,5-trimethyl-4-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrimidine-4,6-diamine
CID 106106808
6-hydrazinyl-5-methyl-2-propan-2-yl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidin-4-amine
CID 81007615
6-hydrazinyl-5-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-propylpyrimidin-4-amine
CID 82874497
6-N-ethyl-4-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidine-4,6-diamine
CID 106106860
N-butyl-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 81000479
6-hydrazinyl-N-(2-methoxyethyl)-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 81001779
6-hydrazinyl-N-[2-(1-methylpyrazol-3-yl)ethyl]pyridin-2-amine
CID 106106888
3-chloro-5,6-dimethyl-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazin-2-amine
CID 106106127
6-hydrazinyl-5-methyl-2-propan-2-yl-N-(3,3,3-trifluoropropyl)pyrimidin-4-amine
CID 81006788
4-[(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)amino]butan-1-ol
CID 106847086
6-hydrazinyl-5-methyl-N-octyl-2-propan-2-ylpyrimidin-4-amine
CID 115565447

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine (CID 106106901) is 6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine is Cc1c(NN)nc(C(C)C)nc1NCCc1ccn(C)n1.
What is the InChIKey of 6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is OHUXYKSIGKKPRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N7/c1-9(2)12-17-13(10(3)14(18-12)19-15)16-7-5-11-6-8-21(4)20-11/h6,8-9H,5,7,15H2,1-4H3,(H2,16,17,18,19).
What are the key properties of 6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine?
6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 289.39 g/mol, XLogP of 1.58, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-5-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 106106901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).