(2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide

C15H24N4O — CID 103928713

IUPAC(2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide
SMILESCC(C)(C)[C@@H](N)C(=O)Nc1ccc(N2CCCC2)nc1
InChIInChI=1S/C15H24N4O/c1-15(2,3)13(16)14(20)18-11-6-7-12(17-10-11)19-8-4-5-9-19/h6-7,10,13H,4-5,8-9,16H2,1-3H3,(H,18,20)/t13-/m0/s1
InChIKeyBXUWLXNNXYNCPI-ZDUSSCGKSA-N
MW276.38 g/mol
LogP1.99
Rot. Bonds3

About (2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide

(2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide (PubChem CID 103928713) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is (2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide.

Molecular Properties

Compound Name(2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide
PubChem CID103928713
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name(2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide
SMILESCC(C)(C)[C@@H](N)C(=O)Nc1ccc(N2CCCC2)nc1
InChIInChI=1S/C15H24N4O/c1-15(2,3)13(16)14(20)18-11-6-7-12(17-10-11)19-8-4-5-9-19/h6-7,10,13H,4-5,8-9,16H2,1-3H3,(H,18,20)/t13-/m0/s1
InChIKeyBXUWLXNNXYNCPI-ZDUSSCGKSA-N
XLogP1.99
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-amino-3,3-dimethyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
CID 103928716
2-amino-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
CID 43704585
N-[6-(azepan-1-yl)-3-pyridinyl]-2,2-dimethylpropanamide
CID 113015875
2-(aminomethyl)-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide
CID 65224657
3-amino-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide
CID 60836509
2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
CID 18143999
2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
CID 65224805
4-amino-2-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
CID 80543440
tert-butyl N-[6-(azepan-1-yl)-3-pyridinyl]carbamate
CID 113015925
3-chloro-2,2-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide
CID 63679043
(2S)-2-amino-N-(6-fluoro-3-pyridinyl)-3,3-dimethylbutanamide
CID 103808708
4-amino-N-(6-pyrrolidin-1-yl-3-pyridinyl)pentanamide;dihydrochloride
CID 120564420

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide?
The IUPAC name of (2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide (CID 103928713) is (2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide.
What is the SMILES notation for (2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide?
The canonical SMILES for (2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide is CC(C)(C)[C@@H](N)C(=O)Nc1ccc(N2CCCC2)nc1.
What is the InChIKey of (2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide?
The InChIKey is BXUWLXNNXYNCPI-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H24N4O/c1-15(2,3)13(16)14(20)18-11-6-7-12(17-10-11)19-8-4-5-9-19/h6-7,10,13H,4-5,8-9,16H2,1-3H3,(H,18,20)/t13-/m0/s1.
What are the key properties of (2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide?
(2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide has a molecular weight of 276.38 g/mol, XLogP of 1.99, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide is sourced from PubChem (CID 103928713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).