N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide

C14H22N4O — CID 91648208

IUPACN-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide
SMILESCc1cnc(C)c(NCCC(=O)NC2CCCC2)n1
InChIInChI=1S/C14H22N4O/c1-10-9-16-11(2)14(17-10)15-8-7-13(19)18-12-5-3-4-6-12/h9,12H,3-8H2,1-2H3,(H,15,17)(H,18,19)
InChIKeyPTRYLUWOSNIEEM-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.95
Rot. Bonds5

About N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide

N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide (PubChem CID 91648208) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide
PubChem CID91648208
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC NameN-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide
SMILESCc1cnc(C)c(NCCC(=O)NC2CCCC2)n1
InChIInChI=1S/C14H22N4O/c1-10-9-16-11(2)14(17-10)15-8-7-13(19)18-12-5-3-4-6-12/h9,12H,3-8H2,1-2H3,(H,15,17)(H,18,19)
InChIKeyPTRYLUWOSNIEEM-UHFFFAOYSA-N
XLogP1.95
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide
CID 80849479
N-cyclopropyl-3-[(4,6-dimethylpyrimidin-2-yl)amino]propanamide
CID 79393988
N'-cyclopentyl-N-(3,6-dimethylpyrazin-2-yl)-N'-methylethane-1,2-diamine
CID 65417550
N-cyclohexyl-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide
CID 109014106
3-(3-bromo-4-methylanilino)-N-cyclopentylpropanamide
CID 109013519
N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide
CID 80922661
N-cyclohexyl-3-[(6-cyclopentyl-1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]propanamide
CID 70756161
N-cycloheptyl-3,6-dimethylpyrazin-2-amine
CID 60631763
N-cycloheptyl-3-(3,4-dichloroanilino)propanamide
CID 109031534
N-cyclopentyl-3-(2,6-diethylanilino)propanamide
CID 109013502
N-cyclopentyl-3-(4-ethylanilino)propanamide
CID 109013496
3-[(5-bromo-3-pyridinyl)amino]-N-cyclopentylpropanamide
CID 71996706

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide?
The IUPAC name of N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide (CID 91648208) is N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide.
What is the SMILES notation for N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide?
The canonical SMILES for N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide is Cc1cnc(C)c(NCCC(=O)NC2CCCC2)n1.
What is the InChIKey of N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide?
The InChIKey is PTRYLUWOSNIEEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-10-9-16-11(2)14(17-10)15-8-7-13(19)18-12-5-3-4-6-12/h9,12H,3-8H2,1-2H3,(H,15,17)(H,18,19).
What are the key properties of N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide?
N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide has a molecular weight of 262.36 g/mol, XLogP of 1.95, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide is sourced from PubChem (CID 91648208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).