N-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide

C12H19N5O2 — CID 95755294

IUPACN-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide
SMILESCN(C)Cc1cc(NC(=O)CNC(=O)C2CC2)n[nH]1
InChIInChI=1S/C12H19N5O2/c1-17(2)7-9-5-10(16-15-9)14-11(18)6-13-12(19)8-3-4-8/h5,8H,3-4,6-7H2,1-2H3,(H,13,19)(H2,14,15,16,18)
InChIKeyYZXCYMUFVOLFSB-UHFFFAOYSA-N
MW265.32 g/mol
LogP-0.06
Rot. Bonds6

About N-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide

N-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide (PubChem CID 95755294) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is N-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide
PubChem CID95755294
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC NameN-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide
SMILESCN(C)Cc1cc(NC(=O)CNC(=O)C2CC2)n[nH]1
InChIInChI=1S/C12H19N5O2/c1-17(2)7-9-5-10(16-15-9)14-11(18)6-13-12(19)8-3-4-8/h5,8H,3-4,6-7H2,1-2H3,(H,13,19)(H2,14,15,16,18)
InChIKeyYZXCYMUFVOLFSB-UHFFFAOYSA-N
XLogP-0.06
TPSA90.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 5-0.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]-2-(3,5-dimethylphenoxy)acetamide
CID 95755102
N-(5-propyl-1H-pyrazol-3-yl)cyclopropanecarboxamide
CID 115619791
N-(5-ethyl-1H-pyrazol-3-yl)-4-methylcyclohexane-1-carboxamide
CID 113245552
N-[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]-2-(2-methylphenoxy)acetamide
CID 95755104
N-[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]-1-methyl-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide
CID 110281578
N-[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]-3-phenylpropanamide
CID 95755349
N-(5-methyl-1H-pyrazol-3-yl)cyclooctanecarboxamide
CID 65022914
1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide
CID 60973723
4-[[5-[2-(2-methylphenyl)ethyl]-1H-pyrazol-3-yl]carbamoyl]cyclohexane-1-carboxylic acid
CID 155952452
N-(5-ethyl-1H-pyrazol-3-yl)cyclopent-3-ene-1-carboxamide
CID 115644958
N-[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]-N'-(5-propyl-1,3,4-thiadiazol-2-yl)butanediamide
CID 95755192
N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]cyclopentanecarboxamide
CID 46429748

Frequently Asked Questions

What is the IUPAC name of N-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide (CID 95755294) is N-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide is CN(C)Cc1cc(NC(=O)CNC(=O)C2CC2)n[nH]1.
What is the InChIKey of N-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide?
The InChIKey is YZXCYMUFVOLFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-17(2)7-9-5-10(16-15-9)14-11(18)6-13-12(19)8-3-4-8/h5,8H,3-4,6-7H2,1-2H3,(H,13,19)(H2,14,15,16,18).
What are the key properties of N-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide?
N-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide has a molecular weight of 265.32 g/mol, XLogP of -0.06, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]amino]-2-oxoethyl]cyclopropanecarboxamide is sourced from PubChem (CID 95755294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).