2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide

C19H24N4O2 — CID 119725693

IUPAC2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide
SMILESCNCC(C)C(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C
InChIInChI=1S/C19H24N4O2/c1-13-9-10-16(11-17(13)23-18(24)14(2)12-20-3)22-19(25)21-15-7-5-4-6-8-15/h4-11,14,20H,12H2,1-3H3,(H,23,24)(H2,21,22,25)
InChIKeyGECAQHZAVZRDQR-UHFFFAOYSA-N
MW340.43 g/mol
LogP3.43
Rot. Bonds6

About 2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide

2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide (PubChem CID 119725693) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide.

Molecular Properties

Compound Name2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide
PubChem CID119725693
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide
SMILESCNCC(C)C(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C
InChIInChI=1S/C19H24N4O2/c1-13-9-10-16(11-17(13)23-18(24)14(2)12-20-3)22-19(25)21-15-7-5-4-6-8-15/h4-11,14,20H,12H2,1-3H3,(H,23,24)(H2,21,22,25)
InChIKeyGECAQHZAVZRDQR-UHFFFAOYSA-N
XLogP3.43
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 53.43
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide?
The IUPAC name of 2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide (CID 119725693) is 2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide.
What is the SMILES notation for 2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide?
The canonical SMILES for 2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide is CNCC(C)C(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C.
What is the InChIKey of 2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide?
The InChIKey is GECAQHZAVZRDQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-13-9-10-16(11-17(13)23-18(24)14(2)12-20-3)22-19(25)21-15-7-5-4-6-8-15/h4-11,14,20H,12H2,1-3H3,(H,23,24)(H2,21,22,25).
What are the key properties of 2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide?
2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide has a molecular weight of 340.43 g/mol, XLogP of 3.43, 6 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(methylamino)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]propanamide is sourced from PubChem (CID 119725693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).