N-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide

C12H20N4O — CID 65192220

IUPACN-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide
SMILESCc1nn(C)cc1C(C)NCC(=O)NC1CC1
InChIInChI=1S/C12H20N4O/c1-8(11-7-16(3)15-9(11)2)13-6-12(17)14-10-4-5-10/h7-8,10,13H,4-6H2,1-3H3,(H,14,17)
InChIKeyGTTFFJMLFDCTDZ-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.66
Rot. Bonds5

About N-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide

N-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide (PubChem CID 65192220) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is N-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide
PubChem CID65192220
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC NameN-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide
SMILESCc1nn(C)cc1C(C)NCC(=O)NC1CC1
InChIInChI=1S/C12H20N4O/c1-8(11-7-16(3)15-9(11)2)13-6-12(17)14-10-4-5-10/h7-8,10,13H,4-6H2,1-3H3,(H,14,17)
InChIKeyGTTFFJMLFDCTDZ-UHFFFAOYSA-N
XLogP0.66
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2-methylprop-2-en-1-amine
CID 115903248
N-(cyclobutylmethyl)-1-(1,3-dimethylpyrazol-4-yl)ethanamine
CID 65191855
3-cyclopropyl-N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]propan-1-amine
CID 115890681
(2R)-1-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]propan-2-ol
CID 103906693
N-cycloheptyl-2-[(1,3-dimethylpyrazol-4-yl)amino]acetamide
CID 102805314
N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-4-ethylcyclohexan-1-amine
CID 65196831
2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-cyclopropylacetamide
CID 81378498
1-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-3-(3-methylsulfanylcyclopentyl)urea
CID 71990300
1-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]-2-methylpropan-2-ol
CID 65197340
4-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]butan-1-ol
CID 106841146
1-[(1R)-1-(1,3-dimethylpyrazol-4-yl)ethyl]-3-(1-pyrimidin-2-ylpiperidin-4-yl)urea
CID 95272461
N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide
CID 81363494

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide?
The IUPAC name of N-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide (CID 65192220) is N-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide is Cc1nn(C)cc1C(C)NCC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide?
The InChIKey is GTTFFJMLFDCTDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-8(11-7-16(3)15-9(11)2)13-6-12(17)14-10-4-5-10/h7-8,10,13H,4-6H2,1-3H3,(H,14,17).
What are the key properties of N-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide?
N-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide has a molecular weight of 236.32 g/mol, XLogP of 0.66, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[1-(1,3-dimethylpyrazol-4-yl)ethylamino]acetamide is sourced from PubChem (CID 65192220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).