N,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide

C19H24N4O2 — CID 71990686

IUPACN,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide
SMILESCC(NC(=O)NCCc1cccc(C(=O)N(C)C)c1)c1ccccn1
InChIInChI=1S/C19H24N4O2/c1-14(17-9-4-5-11-20-17)22-19(25)21-12-10-15-7-6-8-16(13-15)18(24)23(2)3/h4-9,11,13-14H,10,12H2,1-3H3,(H2,21,22,25)
InChIKeySGJUCDVTPIJNPB-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.39
Rot. Bonds6

About N,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide

N,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide (PubChem CID 71990686) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide
PubChem CID71990686
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide
SMILESCC(NC(=O)NCCc1cccc(C(=O)N(C)C)c1)c1ccccn1
InChIInChI=1S/C19H24N4O2/c1-14(17-9-4-5-11-20-17)22-19(25)21-12-10-15-7-6-8-16(13-15)18(24)23(2)3/h4-9,11,13-14H,10,12H2,1-3H3,(H2,21,22,25)
InChIKeySGJUCDVTPIJNPB-UHFFFAOYSA-N
XLogP2.39
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(3-fluorophenyl)ethyl]-3-[(1S)-1-pyridin-2-ylethyl]urea
CID 36962482
1-(4-phenylbutyl)-3-[(1S)-1-pyridin-2-ylethyl]urea
CID 36520752
N,N-dimethyl-3-[2-[[N'-methyl-N-(pyridin-2-ylmethyl)carbamimidoyl]amino]ethyl]benzamide
CID 111668260
3-[2-(4-aminopentanoylamino)ethyl]-N,N-dimethylbenzamide;hydrochloride
CID 120563368
N,N-dimethyl-3-[2-[(N'-methyl-N-propan-2-ylcarbamimidoyl)amino]ethyl]benzamide
CID 111771916
1-[2-(5-bromo-2-fluorophenyl)ethyl]-3-(1-pyridin-2-ylethyl)urea
CID 48636675
3-[2-[(2-hydroxy-2-phenylacetyl)amino]ethyl]-N,N-dimethylbenzamide
CID 111540238
3-[2-[[N-ethyl-N'-(2-pyridin-2-ylethyl)carbamimidoyl]amino]ethyl]-N,N-dimethylbenzamide
CID 111667870
N-[(2S)-butan-2-yl]-3-[[(1S)-1-pyridin-2-ylethyl]carbamoylamino]propanamide
CID 94656519
1-[2-(3-fluorophenyl)ethyl]-3-[(R)-phenyl(pyridin-2-yl)methyl]urea
CID 36962476
3-[2-[1-(dimethylamino)propan-2-ylcarbamoylamino]ethyl]benzoic acid
CID 82940042
1-[(3-fluoro-4-methylphenyl)methyl]-3-[(1S)-1-pyridin-2-ylethyl]urea
CID 33431185

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide?
The IUPAC name of N,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide (CID 71990686) is N,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide.
What is the SMILES notation for N,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide?
The canonical SMILES for N,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide is CC(NC(=O)NCCc1cccc(C(=O)N(C)C)c1)c1ccccn1.
What is the InChIKey of N,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide?
The InChIKey is SGJUCDVTPIJNPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-14(17-9-4-5-11-20-17)22-19(25)21-12-10-15-7-6-8-16(13-15)18(24)23(2)3/h4-9,11,13-14H,10,12H2,1-3H3,(H2,21,22,25).
What are the key properties of N,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide?
N,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide has a molecular weight of 340.43 g/mol, XLogP of 2.39, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[2-(1-pyridin-2-ylethylcarbamoylamino)ethyl]benzamide is sourced from PubChem (CID 71990686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).