3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine

C11H17N3 — CID 131092034

IUPAC3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine
SMILESCC1(C)CC(NCc2ccncn2)C1
InChIInChI=1S/C11H17N3/c1-11(2)5-10(6-11)13-7-9-3-4-12-8-14-9/h3-4,8,10,13H,5-7H2,1-2H3
InChIKeyUXVUYYRROKWAKC-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.75
Rot. Bonds3

About 3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine

3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine (PubChem CID 131092034) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine.

Molecular Properties

Compound Name3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine
PubChem CID131092034
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine
SMILESCC1(C)CC(NCc2ccncn2)C1
InChIInChI=1S/C11H17N3/c1-11(2)5-10(6-11)13-7-9-3-4-12-8-14-9/h3-4,8,10,13H,5-7H2,1-2H3
InChIKeyUXVUYYRROKWAKC-UHFFFAOYSA-N
XLogP1.75
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine with MolForge

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

Launch Full Analysis

Related Compounds

3-phenyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine
CID 114110664
N-(pyrimidin-4-ylmethyl)oxan-3-amine
CID 63360348
N-(pyrimidin-4-ylmethyl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 62747106
4-(pyrimidin-4-ylmethylamino)pyrrolidin-2-one
CID 106182416
3,3-dimethyl-N-(pyrimidin-2-ylmethyl)cyclobutan-1-amine
CID 130820453
1,1-dioxo-N-(pyrimidin-4-ylmethyl)thiolan-3-amine
CID 62760025
3-(pyrimidin-4-ylmethylamino)cyclohexane-1-carboxylic acid
CID 65066829
1-propylsulfonyl-N-(pyrimidin-4-ylmethyl)piperidin-4-amine
CID 62748365
1-cyclopropyl-N-(pyrimidin-4-ylmethyl)ethanamine
CID 62760766
3-(pyrimidin-4-ylmethylamino)piperidin-2-one
CID 62748926
tert-butyl 4-(pyrimidin-4-ylmethylamino)azepane-1-carboxylate
CID 107255037
1-cyclopentyl-N-(pyrimidin-4-ylmethyl)methanamine
CID 62760594

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine?
The IUPAC name of 3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine (CID 131092034) is 3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine.
What is the SMILES notation for 3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine?
The canonical SMILES for 3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine is CC1(C)CC(NCc2ccncn2)C1.
What is the InChIKey of 3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine?
The InChIKey is UXVUYYRROKWAKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-11(2)5-10(6-11)13-7-9-3-4-12-8-14-9/h3-4,8,10,13H,5-7H2,1-2H3.
What are the key properties of 3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine?
3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine has a molecular weight of 191.28 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-N-(pyrimidin-4-ylmethyl)cyclobutan-1-amine is sourced from PubChem (CID 131092034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).