N-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide

C14H22N4O2 — CID 79394717

IUPACN-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide
SMILESCC(C)Cn1ccnc(NCCC(=O)NC2CC2)c1=O
InChIInChI=1S/C14H22N4O2/c1-10(2)9-18-8-7-16-13(14(18)20)15-6-5-12(19)17-11-3-4-11/h7-8,10-11H,3-6,9H2,1-2H3,(H,15,16)(H,17,19)
InChIKeySSRAMSNGRUUNGS-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.98
Rot. Bonds7

About N-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide

N-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide (PubChem CID 79394717) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide
PubChem CID79394717
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC NameN-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide
SMILESCC(C)Cn1ccnc(NCCC(=O)NC2CC2)c1=O
InChIInChI=1S/C14H22N4O2/c1-10(2)9-18-8-7-16-13(14(18)20)15-6-5-12(19)17-11-3-4-11/h7-8,10-11H,3-6,9H2,1-2H3,(H,15,16)(H,17,19)
InChIKeySSRAMSNGRUUNGS-UHFFFAOYSA-N
XLogP0.98
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-tert-butyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide
CID 115883760
3-[3-(cyclopropylamino)propylamino]-1-(2-methylpropyl)pyrazin-2-one
CID 62928309
N-cyclopropyl-4-[(3-oxo-4-propylpyrazin-2-yl)amino]butanamide
CID 79400978
3-(2-cyclobutylethylamino)-1-(2-methylpropyl)pyrazin-2-one
CID 115883841
N-[2-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]ethyl]acetamide
CID 55155069
3-(cyclopropylmethylamino)-1-(2-methylpropyl)pyrazin-2-one
CID 62938956
3-[2-(methylamino)ethylamino]-1-(2-methylpropyl)pyrazin-2-one
CID 62927277
1-(2-methylpropyl)-3-(pentylamino)pyrazin-2-one
CID 62940519
3-(7-methyloctylamino)-1-(2-methylpropyl)pyrazin-2-one
CID 107816214
1-(2-methylpropyl)-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one
CID 115765269
3-[(1-methylpiperidin-4-yl)amino]-1-(2-methylpropyl)pyrazin-2-one
CID 55156990
3-[(3-ethylsulfanylcyclopentyl)amino]-1-(2-methylpropyl)pyrazin-2-one
CID 103888844

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide?
The IUPAC name of N-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide (CID 79394717) is N-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide?
The canonical SMILES for N-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide is CC(C)Cn1ccnc(NCCC(=O)NC2CC2)c1=O.
What is the InChIKey of N-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide?
The InChIKey is SSRAMSNGRUUNGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-10(2)9-18-8-7-16-13(14(18)20)15-6-5-12(19)17-11-3-4-11/h7-8,10-11H,3-6,9H2,1-2H3,(H,15,16)(H,17,19).
What are the key properties of N-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide?
N-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide has a molecular weight of 278.36 g/mol, XLogP of 0.98, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]propanamide is sourced from PubChem (CID 79394717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).