N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine

C14H26N6 — CID 105421023

IUPACN-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1nc(NN)cc(NCC2(N(C)C)CCC2)n1
InChIInChI=1S/C14H26N6/c1-10(2)13-17-11(8-12(18-13)19-15)16-9-14(20(3)4)6-5-7-14/h8,10H,5-7,9,15H2,1-4H3,(H2,16,17,18,19)
InChIKeyRVKCEEAPJXUZQU-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.78
Rot. Bonds6

About N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine

N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine (PubChem CID 105421023) has the molecular formula C14H26N6 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
PubChem CID105421023
Molecular FormulaC14H26N6
Molecular Weight278.40 g/mol
Exact Mass278.22
IUPAC NameN-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1nc(NN)cc(NCC2(N(C)C)CCC2)n1
InChIInChI=1S/C14H26N6/c1-10(2)13-17-11(8-12(18-13)19-15)16-9-14(20(3)4)6-5-7-14/h8,10H,5-7,9,15H2,1-4H3,(H2,16,17,18,19)
InChIKeyRVKCEEAPJXUZQU-UHFFFAOYSA-N
XLogP1.78
TPSA79.10 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine (CID 105421023) is N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine is CC(C)c1nc(NN)cc(NCC2(N(C)C)CCC2)n1.
What is the InChIKey of N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is RVKCEEAPJXUZQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N6/c1-10(2)13-17-11(8-12(18-13)19-15)16-9-14(20(3)4)6-5-7-14/h8,10H,5-7,9,15H2,1-4H3,(H2,16,17,18,19).
What are the key properties of N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine?
N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 278.40 g/mol, XLogP of 1.78, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 105421023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).