N-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine

C15H25N3 — CID 102540222

IUPACN-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine
SMILESCCC(C)Nc1ccc(C2CCCN2CC)cn1
InChIInChI=1S/C15H25N3/c1-4-12(3)17-15-9-8-13(11-16-15)14-7-6-10-18(14)5-2/h8-9,11-12,14H,4-7,10H2,1-3H3,(H,16,17)
InChIKeyZRAWYNKXGOZLFJ-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.45
Rot. Bonds5

About N-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine

N-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine (PubChem CID 102540222) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine
PubChem CID102540222
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine
SMILESCCC(C)Nc1ccc(C2CCCN2CC)cn1
InChIInChI=1S/C15H25N3/c1-4-12(3)17-15-9-8-13(11-16-15)14-7-6-10-18(14)5-2/h8-9,11-12,14H,4-7,10H2,1-3H3,(H,16,17)
InChIKeyZRAWYNKXGOZLFJ-UHFFFAOYSA-N
XLogP3.45
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-butan-2-yl]-5-[(2R)-1-propylpiperidin-2-yl]pyridin-2-amine
CID 124552654
5-(1-ethylpyrrolidin-2-yl)-N-phenylpyridin-2-amine
CID 102540510
N-cyclobutyl-5-(1-ethylpiperidin-2-yl)pyridin-2-amine
CID 102540395
5-(1-butylpyrrolidin-2-yl)-N-phenylpyridin-2-amine
CID 102540517
5-(1-ethylpyrrolidin-2-yl)-2-phenylmethoxypyridine
CID 102539475
tert-butyl N-[5-(1-ethylpyrrolidin-2-yl)-2-pyridinyl]-N-propan-2-ylcarbamate
CID 102540926
N-phenyl-5-(1-propylpiperidin-2-yl)pyridin-2-amine
CID 102540524
N-butan-2-yl-3-(1-ethylpiperidin-2-yl)pyridin-2-amine
CID 102540203
N-butyl-5-(1-methylpyrrolidin-2-yl)pyridin-2-amine
CID 102540283
N-cyclopentyl-5-(1-propan-2-ylpyrrolidin-2-yl)pyridin-2-amine
CID 102540450
tert-butyl N-[5-(1-ethylpyrrolidin-2-yl)-2-pyridinyl]-N-(2-methylpropyl)carbamate
CID 102540766
tert-butyl 2-[6-(2-methylpropylamino)-3-pyridinyl]pyrrolidine-1-carboxylate
CID 102540161

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine?
The IUPAC name of N-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine (CID 102540222) is N-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine.
What is the SMILES notation for N-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine?
The canonical SMILES for N-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine is CCC(C)Nc1ccc(C2CCCN2CC)cn1.
What is the InChIKey of N-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine?
The InChIKey is ZRAWYNKXGOZLFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-4-12(3)17-15-9-8-13(11-16-15)14-7-6-10-18(14)5-2/h8-9,11-12,14H,4-7,10H2,1-3H3,(H,16,17).
What are the key properties of N-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine?
N-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine has a molecular weight of 247.39 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-5-(1-ethylpyrrolidin-2-yl)pyridin-2-amine is sourced from PubChem (CID 102540222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).