N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine

C13H23N5 — CID 80968637

IUPACN-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1nc(NN)cc(N(C)C2CCCC2)n1
InChIInChI=1S/C13H23N5/c1-9(2)13-15-11(17-14)8-12(16-13)18(3)10-6-4-5-7-10/h8-10H,4-7,14H2,1-3H3,(H,15,16,17)
InChIKeyOPYOUKSCWMKPBC-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.26
Rot. Bonds4

About N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine

N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine (PubChem CID 80968637) has the molecular formula C13H23N5 and a molecular weight of 249.36 g/mol. Its IUPAC name is N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine
PubChem CID80968637
Molecular FormulaC13H23N5
Molecular Weight249.36 g/mol
Exact Mass249.20
IUPAC NameN-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1nc(NN)cc(N(C)C2CCCC2)n1
InChIInChI=1S/C13H23N5/c1-9(2)13-15-11(17-14)8-12(16-13)18(3)10-6-4-5-7-10/h8-10H,4-7,14H2,1-3H3,(H,15,16,17)
InChIKeyOPYOUKSCWMKPBC-UHFFFAOYSA-N
XLogP2.26
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.26
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-(4,4-dimethylcyclohexyl)-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80968908
2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol
CID 102640233
N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine
CID 80968904
4-N-cycloheptyl-6-hydrazinyl-4-N-methylpyrimidine-2,4-diamine
CID 80899128
4-N-cyclopropyl-4-N-methyl-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80967123
4-N,6-N-dimethyl-4-N-(1-methylpiperidin-3-yl)-2-propan-2-ylpyrimidine-4,6-diamine
CID 80957454
N-cyclooctyl-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80968823
N-cyclopropyl-2-ethyl-6-hydrazinyl-N-methylpyrimidin-4-amine
CID 80940513
4-N-cyclohexyl-4-N,6-N-dimethylpyrimidine-2,4,6-triamine
CID 80761777
N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 105421058
6-hydrazinyl-4-N-methyl-4-N-(1-methylpiperidin-4-yl)pyrimidine-2,4-diamine
CID 80927990
2-[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-methylamino]cyclohexan-1-ol
CID 102640212

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine (CID 80968637) is N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine is CC(C)c1nc(NN)cc(N(C)C2CCCC2)n1.
What is the InChIKey of N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is OPYOUKSCWMKPBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5/c1-9(2)13-15-11(17-14)8-12(16-13)18(3)10-6-4-5-7-10/h8-10H,4-7,14H2,1-3H3,(H,15,16,17).
What are the key properties of N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine?
N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 80968637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).