5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide

C15H21N5O — CID 154847565

IUPAC5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide
SMILESCC(C)n1ncc(C(=O)N(C)[C@H](C)c2cccnc2)c1N
InChIInChI=1S/C15H21N5O/c1-10(2)20-14(16)13(9-18-20)15(21)19(4)11(3)12-6-5-7-17-8-12/h5-11H,16H2,1-4H3/t11-/m1/s1
InChIKeyMBZZIWADJVMHHR-LLVKDONJSA-N
MW287.37 g/mol
LogP2.27
Rot. Bonds4

About 5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide

5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide (PubChem CID 154847565) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide
PubChem CID154847565
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide
SMILESCC(C)n1ncc(C(=O)N(C)[C@H](C)c2cccnc2)c1N
InChIInChI=1S/C15H21N5O/c1-10(2)20-14(16)13(9-18-20)15(21)19(4)11(3)12-6-5-7-17-8-12/h5-11H,16H2,1-4H3/t11-/m1/s1
InChIKeyMBZZIWADJVMHHR-LLVKDONJSA-N
XLogP2.27
TPSA77.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-N,N-dimethyl-1-propan-2-ylpyrazole-4-carboxamide
CID 117213760
6-(2,5-dimethylthiophen-3-yl)-N-methyl-1-propan-2-yl-N-(1-pyridin-3-ylethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 60597428
5-chloro-2-fluoro-N-methyl-N-(1-pyridin-3-ylethyl)benzamide
CID 77080919
N-methyl-N-[(1R)-1-pyridin-3-ylethyl]-2-(trifluoromethoxy)benzamide
CID 124614857
5-chloro-N-methyl-N-(1-pyridin-3-ylethyl)furan-2-carboxamide
CID 86858321
1-(5-amino-1-propan-2-ylpyrazol-4-yl)ethanone
CID 119054332
N-methyl-N-(1-pyridin-3-ylethyl)-4-(trifluoromethylsulfanyl)benzamide
CID 60597744
4-(diethylamino)-N-methyl-N-[(1R)-1-pyridin-3-ylethyl]benzamide
CID 95195499
4-methoxy-N-methyl-N-(1-pyridin-3-ylethyl)pyridine-2-carboxamide
CID 90649462
N,6-dimethyl-N-(1-phenylethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 43054671
5-amino-1-methyl-N-(1-pyridin-3-ylethyl)pyrazole-4-carboxamide
CID 115330422
N-methyl-5-phenoxy-N-[(1S)-1-pyridin-3-ylethyl]furan-2-carboxamide
CID 95216320

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide?
The IUPAC name of 5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide (CID 154847565) is 5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide is CC(C)n1ncc(C(=O)N(C)[C@H](C)c2cccnc2)c1N.
What is the InChIKey of 5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide?
The InChIKey is MBZZIWADJVMHHR-LLVKDONJSA-N. The full InChI is InChI=1S/C15H21N5O/c1-10(2)20-14(16)13(9-18-20)15(21)19(4)11(3)12-6-5-7-17-8-12/h5-11H,16H2,1-4H3/t11-/m1/s1.
What are the key properties of 5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide?
5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide has a molecular weight of 287.37 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-methyl-1-propan-2-yl-N-[(1R)-1-pyridin-3-ylethyl]pyrazole-4-carboxamide is sourced from PubChem (CID 154847565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).