N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide

C13H21N3O — CID 81406744

IUPACN-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
SMILESCC(C)CNC(=O)CN[C@H](C)c1ccccn1
InChIInChI=1S/C13H21N3O/c1-10(2)8-16-13(17)9-15-11(3)12-6-4-5-7-14-12/h4-7,10-11,15H,8-9H2,1-3H3,(H,16,17)/t11-/m1/s1
InChIKeyFLEGZOQSOYYFBH-LLVKDONJSA-N
MW235.33 g/mol
LogP1.50
Rot. Bonds6

About N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide

N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide (PubChem CID 81406744) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
PubChem CID81406744
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC NameN-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
SMILESCC(C)CNC(=O)CN[C@H](C)c1ccccn1
InChIInChI=1S/C13H21N3O/c1-10(2)8-16-13(17)9-15-11(3)12-6-4-5-7-14-12/h4-7,10-11,15H,8-9H2,1-3H3,(H,16,17)/t11-/m1/s1
InChIKeyFLEGZOQSOYYFBH-LLVKDONJSA-N
XLogP1.50
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(propan-2-ylamino)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 81407440
N-(4-methylphenyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
CID 81406656
N-(2-methylphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide
CID 81401913
N-(4-bromophenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide
CID 81401760
N-(2-chlorophenyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
CID 81406571
N-[(1R)-1-pyridin-2-ylethyl]propanamide
CID 59509331
ethyl 2-[[(1S)-1-pyridin-2-ylethyl]amino]acetate
CID 81401759
N-methyl-N-propan-2-yl-2-(1-pyridin-2-ylethylamino)acetamide
CID 43396941
N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide
CID 81393069
2-(tert-butylamino)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 81406863
1-(1-pyridin-2-ylethylamino)propan-2-ol
CID 43499405
tert-butyl 2-[[(1S)-1-pyridin-2-ylethyl]amino]acetate
CID 81402004

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide?
The IUPAC name of N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide (CID 81406744) is N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide?
The canonical SMILES for N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide is CC(C)CNC(=O)CN[C@H](C)c1ccccn1.
What is the InChIKey of N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide?
The InChIKey is FLEGZOQSOYYFBH-LLVKDONJSA-N. The full InChI is InChI=1S/C13H21N3O/c1-10(2)8-16-13(17)9-15-11(3)12-6-4-5-7-14-12/h4-7,10-11,15H,8-9H2,1-3H3,(H,16,17)/t11-/m1/s1.
What are the key properties of N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide?
N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide has a molecular weight of 235.33 g/mol, XLogP of 1.50, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide is sourced from PubChem (CID 81406744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).