N-benzyl-N-(1-cyclopropylethyl)pentanamide

C17H25NO — CID 78805275

IUPACN-benzyl-N-(1-cyclopropylethyl)pentanamide
SMILESCCCCC(=O)N(Cc1ccccc1)C(C)C1CC1
InChIInChI=1S/C17H25NO/c1-3-4-10-17(19)18(14(2)16-11-12-16)13-15-8-6-5-7-9-15/h5-9,14,16H,3-4,10-13H2,1-2H3
InChIKeyVBNPZRUSJIIAAY-UHFFFAOYSA-N
MW259.39 g/mol
LogP4.00
Rot. Bonds7

About N-benzyl-N-(1-cyclopropylethyl)pentanamide

N-benzyl-N-(1-cyclopropylethyl)pentanamide (PubChem CID 78805275) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is N-benzyl-N-(1-cyclopropylethyl)pentanamide.

Molecular Properties

Compound NameN-benzyl-N-(1-cyclopropylethyl)pentanamide
PubChem CID78805275
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC NameN-benzyl-N-(1-cyclopropylethyl)pentanamide
SMILESCCCCC(=O)N(Cc1ccccc1)C(C)C1CC1
InChIInChI=1S/C17H25NO/c1-3-4-10-17(19)18(14(2)16-11-12-16)13-15-8-6-5-7-9-15/h5-9,14,16H,3-4,10-13H2,1-2H3
InChIKeyVBNPZRUSJIIAAY-UHFFFAOYSA-N
XLogP4.00
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-benzyl-5-chloro-N-(1-cyclopropylethyl)pentanamide
CID 60948375
4-amino-N-benzyl-N-(1-cyclopropylethyl)butanamide;hydrochloride
CID 119265829
3-amino-N-benzyl-N-(1-cyclopropylethyl)propanamide;hydrochloride
CID 119265819
N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide
CID 79200111
N-benzyl-N-butan-2-ylpentanamide
CID 78842113
N-benzyl-N-(1-cyclopropylethyl)-3-(ethylamino)butanamide
CID 62839563
N-benzyl-2-(4-bromophenyl)-N-(1-cyclopropylethyl)acetamide
CID 60592231
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
2-(aminomethyl)-N-benzyl-N-(1-cyclopropylethyl)butanamide
CID 65229551
N-benzyl-N-(1-cyclopropylethyl)-2-(2-methoxyethylamino)acetamide
CID 78913957

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(1-cyclopropylethyl)pentanamide?
The IUPAC name of N-benzyl-N-(1-cyclopropylethyl)pentanamide (CID 78805275) is N-benzyl-N-(1-cyclopropylethyl)pentanamide.
What is the SMILES notation for N-benzyl-N-(1-cyclopropylethyl)pentanamide?
The canonical SMILES for N-benzyl-N-(1-cyclopropylethyl)pentanamide is CCCCC(=O)N(Cc1ccccc1)C(C)C1CC1.
What is the InChIKey of N-benzyl-N-(1-cyclopropylethyl)pentanamide?
The InChIKey is VBNPZRUSJIIAAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-3-4-10-17(19)18(14(2)16-11-12-16)13-15-8-6-5-7-9-15/h5-9,14,16H,3-4,10-13H2,1-2H3.
What are the key properties of N-benzyl-N-(1-cyclopropylethyl)pentanamide?
N-benzyl-N-(1-cyclopropylethyl)pentanamide has a molecular weight of 259.39 g/mol, XLogP of 4.00, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(1-cyclopropylethyl)pentanamide is sourced from PubChem (CID 78805275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).