N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide

C11H18N4O — CID 22196200

IUPACN-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
SMILESCN(CC(=O)NC1CC1)Cc1cnn(C)c1
InChIInChI=1S/C11H18N4O/c1-14(6-9-5-12-15(2)7-9)8-11(16)13-10-3-4-10/h5,7,10H,3-4,6,8H2,1-2H3,(H,13,16)
InChIKeyVHJXLWFWPWRETD-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.13
Rot. Bonds5

About N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide

N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide (PubChem CID 22196200) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
PubChem CID22196200
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC NameN-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
SMILESCN(CC(=O)NC1CC1)Cc1cnn(C)c1
InChIInChI=1S/C11H18N4O/c1-14(6-9-5-12-15(2)7-9)8-11(16)13-10-3-4-10/h5,7,10H,3-4,6,8H2,1-2H3,(H,13,16)
InChIKeyVHJXLWFWPWRETD-UHFFFAOYSA-N
XLogP0.13
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide?
The IUPAC name of N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide (CID 22196200) is N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide is CN(CC(=O)NC1CC1)Cc1cnn(C)c1.
What is the InChIKey of N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide?
The InChIKey is VHJXLWFWPWRETD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-14(6-9-5-12-15(2)7-9)8-11(16)13-10-3-4-10/h5,7,10H,3-4,6,8H2,1-2H3,(H,13,16).
What are the key properties of N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide?
N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide has a molecular weight of 222.29 g/mol, XLogP of 0.13, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide is sourced from PubChem (CID 22196200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).