N-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide

C12H20N4O — CID 104934563

IUPACN-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide
SMILESCCc1nn(C)cc1NC(C)C(=O)NC1CC1
InChIInChI=1S/C12H20N4O/c1-4-10-11(7-16(3)15-10)13-8(2)12(17)14-9-5-6-9/h7-9,13H,4-6H2,1-3H3,(H,14,17)
InChIKeyXCOCOAADBKHKMT-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.06
Rot. Bonds5

About N-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide

N-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide (PubChem CID 104934563) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is N-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide
PubChem CID104934563
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC NameN-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide
SMILESCCc1nn(C)cc1NC(C)C(=O)NC1CC1
InChIInChI=1S/C12H20N4O/c1-4-10-11(7-16(3)15-10)13-8(2)12(17)14-9-5-6-9/h7-9,13H,4-6H2,1-3H3,(H,14,17)
InChIKeyXCOCOAADBKHKMT-UHFFFAOYSA-N
XLogP1.06
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 ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl (2R)-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanoate
CID 124679700
ethyl 2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanoate
CID 104700571
cis-(1R,3S)-3-[(3-ethyl-1-methylpyrazol-4-yl)carbamoylamino]cyclopentane-1-carboxylic acid
CID 106320313
2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbutanamide
CID 107463141
3-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-2-methylbutanamide
CID 107463044
3-ethyl-1-methyl-N-pentan-2-ylpyrazol-4-amine
CID 115923160
3-ethyl-1-methyl-N-(2-methylpentan-3-yl)pyrazol-4-amine
CID 115923153
3-ethyl-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine
CID 107462340
N-(1,1-dimethoxypropan-2-yl)-3-ethyl-1-methylpyrazol-4-amine
CID 107462393
2-[(3-ethyl-1-methylpyrazol-4-yl)amino]-N-methylacetamide
CID 107462767
N-(3-ethyl-1-methylpyrazol-4-yl)-1-methylpiperidin-4-amine
CID 115923202
N-(3-ethyl-1-methylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide
CID 107463082

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide?
The IUPAC name of N-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide (CID 104934563) is N-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide?
The canonical SMILES for N-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide is CCc1nn(C)cc1NC(C)C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide?
The InChIKey is XCOCOAADBKHKMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-4-10-11(7-16(3)15-10)13-8(2)12(17)14-9-5-6-9/h7-9,13H,4-6H2,1-3H3,(H,14,17).
What are the key properties of N-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide?
N-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide has a molecular weight of 236.32 g/mol, XLogP of 1.06, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(3-ethyl-1-methylpyrazol-4-yl)amino]propanamide is sourced from PubChem (CID 104934563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).