2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide

C17H25N3O3 — CID 48530161

IUPAC2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide
SMILESCC(C)NC(=O)Nc1ccccc1NC(=O)C(C)OCC1CC1
InChIInChI=1S/C17H25N3O3/c1-11(2)18-17(22)20-15-7-5-4-6-14(15)19-16(21)12(3)23-10-13-8-9-13/h4-7,11-13H,8-10H2,1-3H3,(H,19,21)(H2,18,20,22)
InChIKeyXJHSJMBMJRGJJT-UHFFFAOYSA-N
MW319.41 g/mol
LogP2.97
Rot. Bonds7

About 2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide

2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide (PubChem CID 48530161) has the molecular formula C17H25N3O3 and a molecular weight of 319.41 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide
PubChem CID48530161
Molecular FormulaC17H25N3O3
Molecular Weight319.41 g/mol
Exact Mass319.19
IUPAC Name2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide
SMILESCC(C)NC(=O)Nc1ccccc1NC(=O)C(C)OCC1CC1
InChIInChI=1S/C17H25N3O3/c1-11(2)18-17(22)20-15-7-5-4-6-14(15)19-16(21)12(3)23-10-13-8-9-13/h4-7,11-13H,8-10H2,1-3H3,(H,19,21)(H2,18,20,22)
InChIKeyXJHSJMBMJRGJJT-UHFFFAOYSA-N
XLogP2.97
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 52.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide
CID 43188643
2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide
CID 86846916
N-(4-amino-2-chlorophenyl)-2-(cyclohexylmethoxy)propanamide
CID 62382552
N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
CID 66323873
N-[2-chloro-5-(propanoylamino)phenyl]-2-(cyclopropylmethoxy)propanamide
CID 48521300
(2S)-2-[[(2S)-oxolan-2-yl]methoxy]-N-(2-propan-2-yloxyphenyl)propanamide
CID 94823131
(2S)-2-[[(2R)-oxolan-2-yl]methoxy]-N-(2-propan-2-yloxyphenyl)propanamide
CID 94823133
4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide
CID 47422905
N-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
CID 66321735
2-(cyclopropylmethoxy)-N-(2-hydroxy-5-nitrophenyl)propanamide
CID 102560816
N-(4-cyclopentylsulfonylphenyl)-2-(cyclopropylmethoxy)propanamide
CID 86847260
1-(2-methoxyphenyl)-3-propan-2-ylurea
CID 19167870

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide?
The IUPAC name of 2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide (CID 48530161) is 2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide.
What is the SMILES notation for 2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide?
The canonical SMILES for 2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide is CC(C)NC(=O)Nc1ccccc1NC(=O)C(C)OCC1CC1.
What is the InChIKey of 2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide?
The InChIKey is XJHSJMBMJRGJJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-11(2)18-17(22)20-15-7-5-4-6-14(15)19-16(21)12(3)23-10-13-8-9-13/h4-7,11-13H,8-10H2,1-3H3,(H,19,21)(H2,18,20,22).
What are the key properties of 2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide?
2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide has a molecular weight of 319.41 g/mol, XLogP of 2.97, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide is sourced from PubChem (CID 48530161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).