N-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide

C13H21N3O — CID 28579267

IUPACN-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide
SMILESCC(C)N(C)C(=O)CNCCc1ccccn1
InChIInChI=1S/C13H21N3O/c1-11(2)16(3)13(17)10-14-9-7-12-6-4-5-8-15-12/h4-6,8,11,14H,7,9-10H2,1-3H3
InChIKeyGTNDIQJYCHSRHI-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.08
Rot. Bonds6

About N-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide

N-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide (PubChem CID 28579267) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is N-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide.

Molecular Properties

Compound NameN-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide
PubChem CID28579267
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC NameN-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide
SMILESCC(C)N(C)C(=O)CNCCc1ccccn1
InChIInChI=1S/C13H21N3O/c1-11(2)16(3)13(17)10-14-9-7-12-6-4-5-8-15-12/h4-6,8,11,14H,7,9-10H2,1-3H3
InChIKeyGTNDIQJYCHSRHI-UHFFFAOYSA-N
XLogP1.08
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N',N'-di(propan-2-yl)-N-(2-pyridin-2-ylethyl)ethane-1,2-diamine
CID 60648012
tert-butyl 2-(2-pyridin-2-ylethylamino)acetate
CID 60680814
N-methyl-N-propan-2-yl-2-(1-pyridin-2-ylethylamino)acetamide
CID 43396941
ethane;2-methyl-N-(2-pyridin-2-ylethyl)propanamide
CID 142112887
2-methyl-3-oxo-3-(2-pyridin-2-ylethylamino)propanoic acid
CID 114897299
N-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide
CID 106895876
(2R)-2-methylsulfonyl-N-(2-pyridin-2-ylethyl)propanamide
CID 94025060
N-methyl-2-[2-(1,2,4-oxadiazol-3-yl)ethylamino]-N-propan-2-ylacetamide
CID 106400868
2-methyl-3-(2-pyridin-2-ylethylamino)propan-1-ol
CID 65036147
2-chloro-N-(2-pyridin-2-ylethyl)propanamide
CID 24692533
N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-3-pyridin-2-ylpropanamide
CID 81449728
1-N-(2-pyridin-2-ylethyl)propane-1,2-diamine
CID 115196859

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide?
The IUPAC name of N-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide (CID 28579267) is N-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide.
What is the SMILES notation for N-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide?
The canonical SMILES for N-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide is CC(C)N(C)C(=O)CNCCc1ccccn1.
What is the InChIKey of N-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide?
The InChIKey is GTNDIQJYCHSRHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-11(2)16(3)13(17)10-14-9-7-12-6-4-5-8-15-12/h4-6,8,11,14H,7,9-10H2,1-3H3.
What are the key properties of N-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide?
N-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide has a molecular weight of 235.33 g/mol, XLogP of 1.08, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide is sourced from PubChem (CID 28579267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).