2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide

C15H25N3O — CID 54873824

IUPAC2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide
SMILESCCCCC(N)C(=O)N(Cc1cccnc1)C(C)C
InChIInChI=1S/C15H25N3O/c1-4-5-8-14(16)15(19)18(12(2)3)11-13-7-6-9-17-10-13/h6-7,9-10,12,14H,4-5,8,11,16H2,1-3H3
InChIKeySUOOATBJICKBHH-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.34
Rot. Bonds7

About 2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide

2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide (PubChem CID 54873824) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide.

Molecular Properties

Compound Name2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide
PubChem CID54873824
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide
SMILESCCCCC(N)C(=O)N(Cc1cccnc1)C(C)C
InChIInChI=1S/C15H25N3O/c1-4-5-8-14(16)15(19)18(12(2)3)11-13-7-6-9-17-10-13/h6-7,9-10,12,14H,4-5,8,11,16H2,1-3H3
InChIKeySUOOATBJICKBHH-UHFFFAOYSA-N
XLogP2.34
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-3-methyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)butanamide
CID 54873763
(2S)-2-amino-3-methyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)pentanamide
CID 61174279
(2S)-2-amino-3,3-dimethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)butanamide
CID 61164190
2-(methylamino)-N-propan-2-yl-N-(pyridin-3-ylmethyl)propanamide
CID 62636984
2-amino-N-pentyl-4-phenyl-N-propan-2-ylbutanamide
CID 114926657
3-amino-2,2-dimethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)propanamide
CID 113307589
3-(aminomethyl)-N-propan-2-yl-N-(pyridin-3-ylmethyl)pentanamide
CID 81087098
3,5-diamino-N-propan-2-yl-N-(pyridin-3-ylmethyl)benzamide
CID 61116038
2-amino-N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)pentanamide
CID 43650188
(E)-4-oxo-4-[propan-2-yl(pyridin-3-ylmethyl)amino]but-2-enoic acid
CID 39350700
N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 61215927
3-methyl-5-oxo-5-[propan-2-yl(pyridin-3-ylmethyl)amino]pentanoic acid
CID 62964403

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide?
The IUPAC name of 2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide (CID 54873824) is 2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide.
What is the SMILES notation for 2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide?
The canonical SMILES for 2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide is CCCCC(N)C(=O)N(Cc1cccnc1)C(C)C.
What is the InChIKey of 2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide?
The InChIKey is SUOOATBJICKBHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-5-8-14(16)15(19)18(12(2)3)11-13-7-6-9-17-10-13/h6-7,9-10,12,14H,4-5,8,11,16H2,1-3H3.
What are the key properties of 2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide?
2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide has a molecular weight of 263.38 g/mol, XLogP of 2.34, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-propan-2-yl-N-(pyridin-3-ylmethyl)hexanamide is sourced from PubChem (CID 54873824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).