4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide

C15H20N4O2 — CID 65353910

IUPAC4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide
SMILESCOc1ccccc1CC(C)NC(=O)c1nn(C)cc1N
InChIInChI=1S/C15H20N4O2/c1-10(8-11-6-4-5-7-13(11)21-3)17-15(20)14-12(16)9-19(2)18-14/h4-7,9-10H,8,16H2,1-3H3,(H,17,20)
InChIKeyIQSUDGJRQNVUBL-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.37
Rot. Bonds5

About 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide

4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide (PubChem CID 65353910) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide
PubChem CID65353910
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide
SMILESCOc1ccccc1CC(C)NC(=O)c1nn(C)cc1N
InChIInChI=1S/C15H20N4O2/c1-10(8-11-6-4-5-7-13(11)21-3)17-15(20)14-12(16)9-19(2)18-14/h4-7,9-10H,8,16H2,1-3H3,(H,17,20)
InChIKeyIQSUDGJRQNVUBL-UHFFFAOYSA-N
XLogP1.37
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-methoxyphenyl)propan-2-ylurea
CID 21433825
4-amino-N-(1-methoxy-3-methylbutan-2-yl)-1-methylpyrazole-3-carboxamide
CID 65355744
N-[1-(2-methoxyphenyl)propan-2-yl]-3-oxobutanamide
CID 54867173
3-amino-4-[1-(2-methoxyphenyl)propan-2-ylamino]-4-oxobutanoic acid
CID 64896685
5-hydroxy-N-[1-(2-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide
CID 63859035
N-[1-(2-methoxyphenyl)propan-2-yl]-3-(1,3,5-trimethylpyrazol-4-yl)-1H-pyrazole-5-carboxamide
CID 46963675
4-amino-1-methyl-N-[1-oxo-1-(propylamino)propan-2-yl]pyrazole-3-carboxamide
CID 65353943
methyl (2S)-2-[1-(2-methoxyphenyl)propan-2-ylamino]propanoate
CID 43786749
4-amino-1-ethyl-N-[2-(2-methoxyphenyl)ethyl]pyrazole-3-carboxamide
CID 106259547
phenyl N-[1-(2-methoxyphenyl)propan-2-yl]carbamate
CID 61068601
3-chloro-N-[1-(2-methoxyphenyl)propan-2-yl]propanamide
CID 54867469
4-amino-N-(1-methoxypentan-2-yl)-1-methylpyrazole-3-carboxamide
CID 65355940

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide (CID 65353910) is 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide is COc1ccccc1CC(C)NC(=O)c1nn(C)cc1N.
What is the InChIKey of 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide?
The InChIKey is IQSUDGJRQNVUBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-10(8-11-6-4-5-7-13(11)21-3)17-15(20)14-12(16)9-19(2)18-14/h4-7,9-10H,8,16H2,1-3H3,(H,17,20).
What are the key properties of 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide?
4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 1.37, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-1-methylpyrazole-3-carboxamide is sourced from PubChem (CID 65353910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).