N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide

C17H25NO2 — CID 79200111

IUPACN-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide
SMILESCC(O)CCC(=O)N(Cc1ccccc1)C(C)C1CC1
InChIInChI=1S/C17H25NO2/c1-13(19)8-11-17(20)18(14(2)16-9-10-16)12-15-6-4-3-5-7-15/h3-7,13-14,16,19H,8-12H2,1-2H3
InChIKeyXLEMNBOIRRLZQT-UHFFFAOYSA-N
MW275.39 g/mol
LogP2.97
Rot. Bonds7

About N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide

N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide (PubChem CID 79200111) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide.

Molecular Properties

Compound NameN-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide
PubChem CID79200111
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC NameN-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide
SMILESCC(O)CCC(=O)N(Cc1ccccc1)C(C)C1CC1
InChIInChI=1S/C17H25NO2/c1-13(19)8-11-17(20)18(14(2)16-9-10-16)12-15-6-4-3-5-7-15/h3-7,13-14,16,19H,8-12H2,1-2H3
InChIKeyXLEMNBOIRRLZQT-UHFFFAOYSA-N
XLogP2.97
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-benzyl-N-(1-cyclopropylethyl)propanamide;hydrochloride
CID 119265819
N-benzyl-N-(1-cyclopropylethyl)pentanamide
CID 78805275
N-benzyl-5-chloro-N-(1-cyclopropylethyl)pentanamide
CID 60948375
4-amino-N-benzyl-N-(1-cyclopropylethyl)butanamide;hydrochloride
CID 119265829
N-benzyl-2-(4-bromophenyl)-N-(1-cyclopropylethyl)acetamide
CID 60592231
N-benzyl-N-(1-cyclopropylethyl)-3-(ethylamino)butanamide
CID 62839563
3-amino-N-benzyl-N-(1-cyclopropylethyl)-3-phenylpropanamide
CID 119948804
N-benzyl-N-(1-cyclopropylethyl)-3-(4-fluorophenoxy)propanamide
CID 55595511
2-amino-N-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]acetamide
CID 60939851
N-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide
CID 110879557
N-benzyl-N-(1-cyclopropylethyl)-2-(2-methoxyethylamino)acetamide
CID 78913957
N-benzyl-4-methyl-N-propan-2-ylpentanamide
CID 86978961

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide?
The IUPAC name of N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide (CID 79200111) is N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide.
What is the SMILES notation for N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide?
The canonical SMILES for N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide is CC(O)CCC(=O)N(Cc1ccccc1)C(C)C1CC1.
What is the InChIKey of N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide?
The InChIKey is XLEMNBOIRRLZQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-13(19)8-11-17(20)18(14(2)16-9-10-16)12-15-6-4-3-5-7-15/h3-7,13-14,16,19H,8-12H2,1-2H3.
What are the key properties of N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide?
N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide has a molecular weight of 275.39 g/mol, XLogP of 2.97, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide is sourced from PubChem (CID 79200111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).