N-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide

C13H22N4O — CID 62846095

IUPACN-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide
SMILESCc1cnc(CNC(C)C(=O)NCC(C)C)cn1
InChIInChI=1S/C13H22N4O/c1-9(2)5-17-13(18)11(4)15-8-12-7-14-10(3)6-16-12/h6-7,9,11,15H,5,8H2,1-4H3,(H,17,18)
InChIKeyJLWRVDFLLZBXNG-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.04
Rot. Bonds6

About N-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide

N-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide (PubChem CID 62846095) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide
PubChem CID62846095
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC NameN-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide
SMILESCc1cnc(CNC(C)C(=O)NCC(C)C)cn1
InChIInChI=1S/C13H22N4O/c1-9(2)5-17-13(18)11(4)15-8-12-7-14-10(3)6-16-12/h6-7,9,11,15H,5,8H2,1-4H3,(H,17,18)
InChIKeyJLWRVDFLLZBXNG-UHFFFAOYSA-N
XLogP1.04
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-tert-butyl-2-[(5-methylpyrazin-2-yl)methylamino]propanamide
CID 62847742
(5-methylpyrazin-2-yl)methylurea
CID 62845946
2,6-dimethyl-N-[(5-methylpyrazin-2-yl)methyl]heptan-4-amine
CID 62847163
4-[[[1-(2-methylpropylamino)-1-oxopropan-2-yl]amino]methyl]-1,3-thiazole-2-carboxylic acid
CID 103262575
2-(benzylamino)-N-(2-methylpropyl)propanamide
CID 43086806
1-[(5-methylpyrazin-2-yl)methylamino]propan-2-ol
CID 62847369
2-[(3-methylphenyl)methylamino]-N-(2-methylpropyl)propanamide
CID 60734142
(3Z)-3-amino-3-hydroxyimino-2-methyl-N-[(5-methylpyrazin-2-yl)methyl]propanamide
CID 55122485
N-[(5-methylpyrazin-2-yl)methyl]pentan-2-amine
CID 62846047
N-ethyl-2-[(6-methyl-3-pyridinyl)methylamino]propanamide
CID 62997286
1-methoxy-N-[(5-methylpyrazin-2-yl)methyl]propan-2-amine
CID 62845537
ethyl N-[(5-methylpyrazin-2-yl)methyl]carbamate
CID 64592018

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide?
The IUPAC name of N-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide (CID 62846095) is N-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide.
What is the SMILES notation for N-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide?
The canonical SMILES for N-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide is Cc1cnc(CNC(C)C(=O)NCC(C)C)cn1.
What is the InChIKey of N-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide?
The InChIKey is JLWRVDFLLZBXNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-9(2)5-17-13(18)11(4)15-8-12-7-14-10(3)6-16-12/h6-7,9,11,15H,5,8H2,1-4H3,(H,17,18).
What are the key properties of N-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide?
N-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide has a molecular weight of 250.35 g/mol, XLogP of 1.04, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-[(5-methylpyrazin-2-yl)methylamino]propanamide is sourced from PubChem (CID 62846095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).