2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide

C14H24N4O — CID 65242126

IUPAC2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide
SMILESCNC1(CC(=O)NCc2cnn(C)c2)CCCCC1
InChIInChI=1S/C14H24N4O/c1-15-14(6-4-3-5-7-14)8-13(19)16-9-12-10-17-18(2)11-12/h10-11,15H,3-9H2,1-2H3,(H,16,19)
InChIKeyVLVTWSMGPZMFCZ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.35
Rot. Bonds5

About 2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide

2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide (PubChem CID 65242126) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide
PubChem CID65242126
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide
SMILESCNC1(CC(=O)NCc2cnn(C)c2)CCCCC1
InChIInChI=1S/C14H24N4O/c1-15-14(6-4-3-5-7-14)8-13(19)16-9-12-10-17-18(2)11-12/h10-11,15H,3-9H2,1-2H3,(H,16,19)
InChIKeyVLVTWSMGPZMFCZ-UHFFFAOYSA-N
XLogP1.35
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclohexyl-3-[(1-methylpyrazol-4-yl)methyl]urea
CID 2932925
N-[(1-methylpyrazol-4-yl)methyl]azepane-1-carboxamide
CID 115590808
1-(N'-hydroxycarbamimidoyl)-N-[(1-methylpyrazol-4-yl)methyl]cycloheptane-1-carboxamide
CID 76928237
2-[2-[(1-methylpyrazol-4-yl)methylamino]-2-oxoethyl]sulfanylacetic acid
CID 104569715
2-[2-[(1-methylpyrazol-4-yl)methylamino]-2-oxoethoxy]acetic acid
CID 61350617
5-bromo-N-[(1-methylpyrazol-4-yl)methyl]pentanamide
CID 107909826
N-(1,3-dimethylpyrazol-4-yl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 102805575
N-(1H-imidazol-2-ylmethyl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 65241416
2,2-dimethyl-4-[(1-methylpyrazol-4-yl)methylcarbamoylamino]-4-oxobutanoic acid
CID 65301891
N-ethyl-2-[1-(methylamino)cyclohexyl]acetamide
CID 65240911
1-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazole-4-carboxamide
CID 19474553
1-(2-hydroxycyclohexyl)-3-[(1-methylpyrazol-4-yl)methyl]urea
CID 110933352

Frequently Asked Questions

What is the IUPAC name of 2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide?
The IUPAC name of 2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide (CID 65242126) is 2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide.
What is the SMILES notation for 2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide?
The canonical SMILES for 2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide is CNC1(CC(=O)NCc2cnn(C)c2)CCCCC1.
What is the InChIKey of 2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide?
The InChIKey is VLVTWSMGPZMFCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-15-14(6-4-3-5-7-14)8-13(19)16-9-12-10-17-18(2)11-12/h10-11,15H,3-9H2,1-2H3,(H,16,19).
What are the key properties of 2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide?
2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide has a molecular weight of 264.37 g/mol, XLogP of 1.35, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(methylamino)cyclohexyl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide is sourced from PubChem (CID 65242126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).