6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine

C19H34N6O — CID 133264661

IUPAC6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine
SMILESCOCc1nc(C2CC(N)C2)cc(N(C)CC2CC(C(C)(C)C)NN2)n1
InChIInChI=1S/C19H34N6O/c1-19(2,3)16-8-14(23-24-16)10-25(4)18-9-15(12-6-13(20)7-12)21-17(22-18)11-26-5/h9,12-14,16,23-24H,6-8,10-11,20H2,1-5H3
InChIKeyYPTYEWIVZKJOJX-UHFFFAOYSA-N
MW362.52 g/mol
LogP1.55
Rot. Bonds6

About 6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine

6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine (PubChem CID 133264661) has the molecular formula C19H34N6O and a molecular weight of 362.52 g/mol. Its IUPAC name is 6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine
PubChem CID133264661
Molecular FormulaC19H34N6O
Molecular Weight362.52 g/mol
Exact Mass362.28
IUPAC Name6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine
SMILESCOCc1nc(C2CC(N)C2)cc(N(C)CC2CC(C(C)(C)C)NN2)n1
InChIInChI=1S/C19H34N6O/c1-19(2,3)16-8-14(23-24-16)10-25(4)18-9-15(12-6-13(20)7-12)21-17(22-18)11-26-5/h9,12-14,16,23-24H,6-8,10-11,20H2,1-5H3
InChIKeyYPTYEWIVZKJOJX-UHFFFAOYSA-N
XLogP1.55
TPSA88.33 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.52
LogP ≤ 51.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine?
The IUPAC name of 6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine (CID 133264661) is 6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine.
What is the SMILES notation for 6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine?
The canonical SMILES for 6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine is COCc1nc(C2CC(N)C2)cc(N(C)CC2CC(C(C)(C)C)NN2)n1.
What is the InChIKey of 6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine?
The InChIKey is YPTYEWIVZKJOJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N6O/c1-19(2,3)16-8-14(23-24-16)10-25(4)18-9-15(12-6-13(20)7-12)21-17(22-18)11-26-5/h9,12-14,16,23-24H,6-8,10-11,20H2,1-5H3.
What are the key properties of 6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine?
6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine has a molecular weight of 362.52 g/mol, XLogP of 1.55, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-aminocyclobutyl)-N-[(5-tert-butylpyrazolidin-3-yl)methyl]-2-(methoxymethyl)-N-methylpyrimidin-4-amine is sourced from PubChem (CID 133264661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).