N-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide

C11H18N4O2 — CID 114255812

IUPACN-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide
SMILESCOc1cc(NCCC(=O)NC2CC2)nn1C
InChIInChI=1S/C11H18N4O2/c1-15-11(17-2)7-9(14-15)12-6-5-10(16)13-8-3-4-8/h7-8H,3-6H2,1-2H3,(H,12,14)(H,13,16)
InChIKeyNNCFRIKZWKRJRS-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.51
Rot. Bonds6

About N-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide

N-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide (PubChem CID 114255812) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide
PubChem CID114255812
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC NameN-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide
SMILESCOc1cc(NCCC(=O)NC2CC2)nn1C
InChIInChI=1S/C11H18N4O2/c1-15-11(17-2)7-9(14-15)12-6-5-10(16)13-8-3-4-8/h7-8H,3-6H2,1-2H3,(H,12,14)(H,13,16)
InChIKeyNNCFRIKZWKRJRS-UHFFFAOYSA-N
XLogP0.51
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide?
The IUPAC name of N-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide (CID 114255812) is N-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide?
The canonical SMILES for N-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide is COc1cc(NCCC(=O)NC2CC2)nn1C.
What is the InChIKey of N-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide?
The InChIKey is NNCFRIKZWKRJRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-15-11(17-2)7-9(14-15)12-6-5-10(16)13-8-3-4-8/h7-8H,3-6H2,1-2H3,(H,12,14)(H,13,16).
What are the key properties of N-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide?
N-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide has a molecular weight of 238.29 g/mol, XLogP of 0.51, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide is sourced from PubChem (CID 114255812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).