1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea

C19H25N3O2 — CID 97453326

IUPAC1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea
SMILESCCCc1ccccc1NC(=O)N(C)[C@@H](COC)c1ccccn1
InChIInChI=1S/C19H25N3O2/c1-4-9-15-10-5-6-11-16(15)21-19(23)22(2)18(14-24-3)17-12-7-8-13-20-17/h5-8,10-13,18H,4,9,14H2,1-3H3,(H,21,23)/t18-/m0/s1
InChIKeyOMZZAGWBARMVBF-SFHVURJKSA-N
MW327.43 g/mol
LogP3.89
Rot. Bonds7

About 1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea

1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea (PubChem CID 97453326) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea.

Molecular Properties

Compound Name1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea
PubChem CID97453326
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea
SMILESCCCc1ccccc1NC(=O)N(C)[C@@H](COC)c1ccccn1
InChIInChI=1S/C19H25N3O2/c1-4-9-15-10-5-6-11-16(15)21-19(23)22(2)18(14-24-3)17-12-7-8-13-20-17/h5-8,10-13,18H,4,9,14H2,1-3H3,(H,21,23)/t18-/m0/s1
InChIKeyOMZZAGWBARMVBF-SFHVURJKSA-N
XLogP3.89
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-1-pyridin-2-ylethyl)-1-methyl-3-[2-(piperidin-1-ylmethyl)phenyl]urea
CID 72899411
3-(6-chloro-2-methyl-3-pyridinyl)-1-[(1S)-2-methoxy-1-pyridin-2-ylethyl]-1-methylurea
CID 125159367
2-[[2-(2-methoxyethyl)phenyl]carbamoyl-methylamino]propanoic acid
CID 102907053
3-[2-(2-methoxyethyl)phenyl]-1,1-dimethylurea
CID 102847778
1,1-diethyl-3-(2-propylphenyl)urea
CID 113233204
1-(2-methoxy-1-pyridin-2-ylethyl)-1-methyl-3-[4-(2-oxopyrrolidin-1-yl)phenyl]urea
CID 118791683
3-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methylurea
CID 126447147
N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N-methyl-2-phenylpyrimidine-5-carboxamide
CID 95123486
4-chloro-N-(2-methoxy-1-pyridin-2-ylethyl)-N,1-dimethylpyrazole-3-carboxamide
CID 131933604
N'-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N'-methyl-N-(1,3,4-thiadiazol-2-yl)butanediamide
CID 164632916
N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 70760488
4-(dimethylamino)-4-pyridin-2-ylbutan-2-one
CID 82125654

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea?
The IUPAC name of 1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea (CID 97453326) is 1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea.
What is the SMILES notation for 1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea?
The canonical SMILES for 1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea is CCCc1ccccc1NC(=O)N(C)[C@@H](COC)c1ccccn1.
What is the InChIKey of 1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea?
The InChIKey is OMZZAGWBARMVBF-SFHVURJKSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-4-9-15-10-5-6-11-16(15)21-19(23)22(2)18(14-24-3)17-12-7-8-13-20-17/h5-8,10-13,18H,4,9,14H2,1-3H3,(H,21,23)/t18-/m0/s1.
What are the key properties of 1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea?
1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea has a molecular weight of 327.43 g/mol, XLogP of 3.89, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-1-methyl-3-(2-propylphenyl)urea is sourced from PubChem (CID 97453326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).