N-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide

C14H22N4O — CID 119752785

IUPACN-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide
SMILESCC(C)(C)c1ncc(NC(=O)CC2CCCN2)cn1
InChIInChI=1S/C14H22N4O/c1-14(2,3)13-16-8-11(9-17-13)18-12(19)7-10-5-4-6-15-10/h8-10,15H,4-7H2,1-3H3,(H,18,19)
InChIKeyFAVSPUHBGLYTNS-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.85
Rot. Bonds3

About N-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide

N-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide (PubChem CID 119752785) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is N-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide
PubChem CID119752785
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC NameN-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide
SMILESCC(C)(C)c1ncc(NC(=O)CC2CCCN2)cn1
InChIInChI=1S/C14H22N4O/c1-14(2,3)13-16-8-11(9-17-13)18-12(19)7-10-5-4-6-15-10/h8-10,15H,4-7H2,1-3H3,(H,18,19)
InChIKeyFAVSPUHBGLYTNS-UHFFFAOYSA-N
XLogP1.85
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(diethylamino)-3-pyridinyl]-2-pyrrolidin-2-ylacetamide
CID 61365011
N-(4-acetamidophenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119669050
N-(4-tert-butyl-1,3-thiazol-2-yl)-2-pyrrolidin-2-ylacetamide
CID 54960004
5-[(2-pyrrolidin-2-ylacetyl)amino]benzene-1,3-dicarboxylic acid
CID 61363711
N-(4-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119670724
N-(3-ethoxyphenyl)-2-pyrrolidin-2-ylacetamide
CID 61363868
N-(6-phenoxy-3-pyridinyl)-2-pyrrolidin-2-ylacetamide
CID 119849176
N-(4-chlorophenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119671239
N-(2,4-dimethyl-3-pyridinyl)-2-pyrrolidin-2-ylacetamide
CID 112741904
N-(3,4-dimethylphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119670651
N-(5-propyl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide
CID 104618156
N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide
CID 61366412

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide (CID 119752785) is N-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide is CC(C)(C)c1ncc(NC(=O)CC2CCCN2)cn1.
What is the InChIKey of N-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide?
The InChIKey is FAVSPUHBGLYTNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-14(2,3)13-16-8-11(9-17-13)18-12(19)7-10-5-4-6-15-10/h8-10,15H,4-7H2,1-3H3,(H,18,19).
What are the key properties of N-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide?
N-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide has a molecular weight of 262.36 g/mol, XLogP of 1.85, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butylpyrimidin-5-yl)-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 119752785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).