(2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide

C15H26N4O — CID 103928749

IUPAC(2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide
SMILESCCN(CC)c1ccc(NC(=O)[C@H](N)C(C)(C)C)cn1
InChIInChI=1S/C15H26N4O/c1-6-19(7-2)12-9-8-11(10-17-12)18-14(20)13(16)15(3,4)5/h8-10,13H,6-7,16H2,1-5H3,(H,18,20)/t13-/m0/s1
InChIKeyJXHQILBYMQSZIG-ZDUSSCGKSA-N
MW278.40 g/mol
LogP2.24
Rot. Bonds5

About (2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide

(2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide (PubChem CID 103928749) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is (2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide
PubChem CID103928749
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name(2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide
SMILESCCN(CC)c1ccc(NC(=O)[C@H](N)C(C)(C)C)cn1
InChIInChI=1S/C15H26N4O/c1-6-19(7-2)12-9-8-11(10-17-12)18-14(20)13(16)15(3,4)5/h8-10,13H,6-7,16H2,1-5H3,(H,18,20)/t13-/m0/s1
InChIKeyJXHQILBYMQSZIG-ZDUSSCGKSA-N
XLogP2.24
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide?
The IUPAC name of (2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide (CID 103928749) is (2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide.
What is the SMILES notation for (2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide?
The canonical SMILES for (2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide is CCN(CC)c1ccc(NC(=O)[C@H](N)C(C)(C)C)cn1.
What is the InChIKey of (2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide?
The InChIKey is JXHQILBYMQSZIG-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H26N4O/c1-6-19(7-2)12-9-8-11(10-17-12)18-14(20)13(16)15(3,4)5/h8-10,13H,6-7,16H2,1-5H3,(H,18,20)/t13-/m0/s1.
What are the key properties of (2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide?
(2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide has a molecular weight of 278.40 g/mol, XLogP of 2.24, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3,3-dimethylbutanamide is sourced from PubChem (CID 103928749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).