N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide

C12H19N3O — CID 62997286

IUPACN-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide
SMILESCCNC(=O)C(C)NCc1ccc(C)nc1
InChIInChI=1S/C12H19N3O/c1-4-13-12(16)10(3)15-8-11-6-5-9(2)14-7-11/h5-7,10,15H,4,8H2,1-3H3,(H,13,16)
InChIKeyPLTJDJRLLNBDBS-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.00
Rot. Bonds5

About N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide

N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide (PubChem CID 62997286) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide.

Molecular Properties

Compound NameN-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide
PubChem CID62997286
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide
SMILESCCNC(=O)C(C)NCc1ccc(C)nc1
InChIInChI=1S/C12H19N3O/c1-4-13-12(16)10(3)15-8-11-6-5-9(2)14-7-11/h5-7,10,15H,4,8H2,1-3H3,(H,13,16)
InChIKeyPLTJDJRLLNBDBS-UHFFFAOYSA-N
XLogP1.00
TPSA54.02 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 ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethyl-3-[(6-methyl-3-pyridinyl)methyl]urea
CID 115583860
tert-butyl 2-[(6-methyl-3-pyridinyl)methylamino]propanoate
CID 64687344
2-[(4-bromo-3-methylphenyl)methylamino]-N-ethylpropanamide
CID 66471990
2-[(6-methyl-3-pyridinyl)methylamino]-1-piperidin-1-ylpropan-1-one
CID 62997460
N-ethyl-2-[(4-methylsulfonylphenyl)methylamino]propanamide
CID 61068703
(2S)-2-amino-N-[(6-methyl-3-pyridinyl)methyl]butanamide
CID 79023254
4-[[[1-(ethylamino)-1-oxopropan-2-yl]amino]methyl]-N-methylbenzamide
CID 60732797
N'-hydroxy-2-[(6-methyl-3-pyridinyl)methylamino]propanimidamide
CID 77032579
2-[(6-methyl-3-pyridinyl)methylamino]propan-1-ol
CID 89305217
2-amino-3-methyl-N-[(6-methyl-3-pyridinyl)methyl]pentanamide
CID 62073575
N-ethyl-2-[(4-nitrophenyl)methylamino]propanamide
CID 43400092
methyl 2-[(6-methyl-3-pyridinyl)methylamino]butanoate
CID 115353361

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide?
The IUPAC name of N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide (CID 62997286) is N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide.
What is the SMILES notation for N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide?
The canonical SMILES for N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide is CCNC(=O)C(C)NCc1ccc(C)nc1.
What is the InChIKey of N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide?
The InChIKey is PLTJDJRLLNBDBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-4-13-12(16)10(3)15-8-11-6-5-9(2)14-7-11/h5-7,10,15H,4,8H2,1-3H3,(H,13,16).
What are the key properties of N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide?
N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide has a molecular weight of 221.30 g/mol, XLogP of 1.00, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide is sourced from PubChem (CID 62997286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).