N-(5-amino-2-pyridinyl)-5-methylhexanamide

C12H19N3O — CID 115273731

IUPACN-(5-amino-2-pyridinyl)-5-methylhexanamide
SMILESCC(C)CCCC(=O)Nc1ccc(N)cn1
InChIInChI=1S/C12H19N3O/c1-9(2)4-3-5-12(16)15-11-7-6-10(13)8-14-11/h6-9H,3-5,13H2,1-2H3,(H,14,15,16)
InChIKeyTUXAEFVBCNJRGH-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.43
Rot. Bonds5

About N-(5-amino-2-pyridinyl)-5-methylhexanamide

N-(5-amino-2-pyridinyl)-5-methylhexanamide (PubChem CID 115273731) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-(5-amino-2-pyridinyl)-5-methylhexanamide.

Molecular Properties

Compound NameN-(5-amino-2-pyridinyl)-5-methylhexanamide
PubChem CID115273731
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-(5-amino-2-pyridinyl)-5-methylhexanamide
SMILESCC(C)CCCC(=O)Nc1ccc(N)cn1
InChIInChI=1S/C12H19N3O/c1-9(2)4-3-5-12(16)15-11-7-6-10(13)8-14-11/h6-9H,3-5,13H2,1-2H3,(H,14,15,16)
InChIKeyTUXAEFVBCNJRGH-UHFFFAOYSA-N
XLogP2.43
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-amino-2-pyridinyl)-6-methylheptanamide
CID 115273760
N-(5-amino-2-pyridinyl)-4-(2-methylphenyl)butanamide
CID 115273765
N-(5-amino-2-pyridinyl)-4-(5-methylfuran-2-yl)butanamide
CID 115273771
N-(5-amino-2-pyridinyl)-2-propylpentanamide
CID 82985458
N-(5-cyano-2-pyridinyl)-4-methylpentanamide
CID 55209976
N-(5-amino-2-pyridinyl)-5-methyl-N-propan-2-ylhexanamide
CID 115273941
N-(5-amino-2-pyridinyl)-2-(dimethylamino)propanamide
CID 90369688
butan-2-yl N-(5-amino-2-pyridinyl)carbamate
CID 150685008
4-amino-N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide
CID 82034192
methyl N-(5-amino-2-pyridinyl)carbamate
CID 58772637
1-[4-[(5-amino-2-pyridinyl)amino]piperidin-1-yl]-4-methylpentan-1-one
CID 68719868
N,N'-bis[2-[(5-amino-2-pyridinyl)amino]ethyl]hexanediamide
CID 163474647

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-pyridinyl)-5-methylhexanamide?
The IUPAC name of N-(5-amino-2-pyridinyl)-5-methylhexanamide (CID 115273731) is N-(5-amino-2-pyridinyl)-5-methylhexanamide.
What is the SMILES notation for N-(5-amino-2-pyridinyl)-5-methylhexanamide?
The canonical SMILES for N-(5-amino-2-pyridinyl)-5-methylhexanamide is CC(C)CCCC(=O)Nc1ccc(N)cn1.
What is the InChIKey of N-(5-amino-2-pyridinyl)-5-methylhexanamide?
The InChIKey is TUXAEFVBCNJRGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9(2)4-3-5-12(16)15-11-7-6-10(13)8-14-11/h6-9H,3-5,13H2,1-2H3,(H,14,15,16).
What are the key properties of N-(5-amino-2-pyridinyl)-5-methylhexanamide?
N-(5-amino-2-pyridinyl)-5-methylhexanamide has a molecular weight of 221.30 g/mol, XLogP of 2.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-pyridinyl)-5-methylhexanamide is sourced from PubChem (CID 115273731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).