(2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide

C15H25N3O — CID 103929297

IUPAC(2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide
SMILESCC(C)N(Cc1ccccn1)C(=O)[C@H](N)C(C)(C)C
InChIInChI=1S/C15H25N3O/c1-11(2)18(10-12-8-6-7-9-17-12)14(19)13(16)15(3,4)5/h6-9,11,13H,10,16H2,1-5H3/t13-/m0/s1
InChIKeyBOXDWCMLAHPDEP-ZDUSSCGKSA-N
MW263.38 g/mol
LogP2.19
Rot. Bonds4

About (2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide

(2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide (PubChem CID 103929297) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is (2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide.

Molecular Properties

Compound Name(2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide
PubChem CID103929297
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name(2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide
SMILESCC(C)N(Cc1ccccn1)C(=O)[C@H](N)C(C)(C)C
InChIInChI=1S/C15H25N3O/c1-11(2)18(10-12-8-6-7-9-17-12)14(19)13(16)15(3,4)5/h6-9,11,13H,10,16H2,1-5H3/t13-/m0/s1
InChIKeyBOXDWCMLAHPDEP-ZDUSSCGKSA-N
XLogP2.19
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-2-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)propanamide
CID 114328230
2-amino-N-cyclopropyl-3,3-dimethyl-N-(pyridin-2-ylmethyl)butanamide
CID 76895282
(2S)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)butanamide
CID 61164190
3-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)but-2-enamide
CID 51088401
1-amino-N-propan-2-yl-N-(pyridin-2-ylmethyl)cyclopentane-1-carboxamide
CID 54872425
3-methyl-5-oxo-5-[propan-2-yl(pyridin-2-ylmethyl)amino]pentanoic acid
CID 62964578
4-bromo-N-propan-2-yl-N-(pyridin-2-ylmethyl)benzamide
CID 60956029
1-amino-N-propan-2-yl-N-(pyridin-2-ylmethyl)cyclohexane-1-carboxamide
CID 60947405
2-(azetidin-3-ylidene)-N-propan-2-yl-N-(pyridin-2-ylmethyl)propanamide
CID 116676557
(2S)-2-[bis(pyridin-2-ylmethyl)amino]-N,N-bis(pyridin-2-ylmethyl)propanamide
CID 102088447
2-amino-N-phenyl-N-(pyridin-2-ylmethyl)propanamide
CID 68993512
5-bromo-N-propan-2-yl-N-(pyridin-2-ylmethyl)pentanamide
CID 107909493

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide?
The IUPAC name of (2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide (CID 103929297) is (2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide.
What is the SMILES notation for (2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide?
The canonical SMILES for (2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide is CC(C)N(Cc1ccccn1)C(=O)[C@H](N)C(C)(C)C.
What is the InChIKey of (2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide?
The InChIKey is BOXDWCMLAHPDEP-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H25N3O/c1-11(2)18(10-12-8-6-7-9-17-12)14(19)13(16)15(3,4)5/h6-9,11,13H,10,16H2,1-5H3/t13-/m0/s1.
What are the key properties of (2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide?
(2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide has a molecular weight of 263.38 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)butanamide is sourced from PubChem (CID 103929297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).