2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide

C19H20N4O2 — CID 137425440

IUPAC2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide
SMILESCNC(C(=O)Nc1ccc(-c2cn[nH]c2)cc1)c1cccc(OC)c1
InChIInChI=1S/C19H20N4O2/c1-20-18(14-4-3-5-17(10-14)25-2)19(24)23-16-8-6-13(7-9-16)15-11-21-22-12-15/h3-12,18,20H,1-2H3,(H,21,22)(H,23,24)
InChIKeyRBSPMMLWEZLNPN-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.98
Rot. Bonds6

About 2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide

2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide (PubChem CID 137425440) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide
PubChem CID137425440
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide
SMILESCNC(C(=O)Nc1ccc(-c2cn[nH]c2)cc1)c1cccc(OC)c1
InChIInChI=1S/C19H20N4O2/c1-20-18(14-4-3-5-17(10-14)25-2)19(24)23-16-8-6-13(7-9-16)15-11-21-22-12-15/h3-12,18,20H,1-2H3,(H,21,22)(H,23,24)
InChIKeyRBSPMMLWEZLNPN-UHFFFAOYSA-N
XLogP2.98
TPSA79.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide
CID 137425551
2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]butanamide
CID 153113467
2-(3-methoxyphenyl)-2-(methylamino)acetamide
CID 60797274
2-[3-(dimethylamino)phenyl]-N-[4-(1H-pyrazol-4-yl)phenyl]butanamide
CID 158988611
2-(ethylamino)-2-(4-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide
CID 137425585
N-[4-(3-methoxyphenoxy)phenyl]-4-[4-(1H-pyrazol-4-yl)phenyl]piperidine-4-carboxamide
CID 15981193
1-[2-(dimethylamino)ethyl]-1-[(3-methoxyphenyl)methyl]-3-[4-(1H-pyrazol-4-yl)phenyl]urea
CID 68563058
2-bromo-N-(1H-indazol-5-yl)-2-(3-methoxyphenyl)acetamide
CID 169099717
(2S)-2-amino-2-(3-methoxyphenyl)-N-[3-(1H-pyrazol-4-yl)-1H-indol-7-yl]acetamide
CID 175994897
1-methyl-1-[(3-propan-2-yloxyphenyl)methyl]-3-[4-(1H-pyrazol-4-yl)phenyl]urea
CID 117077809
1-[(2,4-dimethoxyphenyl)methyl]-3-[4-(1H-pyrazol-4-yl)phenyl]urea
CID 71654828
(2R)-3-amino-2-(3-methoxyphenyl)-N-[3-(1H-pyrazol-4-yl)-1H-indol-7-yl]propanamide
CID 178185458

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide?
The IUPAC name of 2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide (CID 137425440) is 2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide.
What is the SMILES notation for 2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide?
The canonical SMILES for 2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide is CNC(C(=O)Nc1ccc(-c2cn[nH]c2)cc1)c1cccc(OC)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide?
The InChIKey is RBSPMMLWEZLNPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-20-18(14-4-3-5-17(10-14)25-2)19(24)23-16-8-6-13(7-9-16)15-11-21-22-12-15/h3-12,18,20H,1-2H3,(H,21,22)(H,23,24).
What are the key properties of 2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide?
2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide has a molecular weight of 336.40 g/mol, XLogP of 2.98, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide is sourced from PubChem (CID 137425440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).