N-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide

C19H28N2O2 — CID 110879557

IUPACN-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide
SMILESCC(C1CC1)N(Cc1ccccc1)C(=O)CN1CCCC(O)C1
InChIInChI=1S/C19H28N2O2/c1-15(17-9-10-17)21(12-16-6-3-2-4-7-16)19(23)14-20-11-5-8-18(22)13-20/h2-4,6-7,15,17-18,22H,5,8-14H2,1H3
InChIKeyZRTBCKGZWBJRAS-UHFFFAOYSA-N
MW316.44 g/mol
LogP2.27
Rot. Bonds6

About N-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide

N-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide (PubChem CID 110879557) has the molecular formula C19H28N2O2 and a molecular weight of 316.44 g/mol. Its IUPAC name is N-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide
PubChem CID110879557
Molecular FormulaC19H28N2O2
Molecular Weight316.44 g/mol
Exact Mass316.22
IUPAC NameN-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide
SMILESCC(C1CC1)N(Cc1ccccc1)C(=O)CN1CCCC(O)C1
InChIInChI=1S/C19H28N2O2/c1-15(17-9-10-17)21(12-16-6-3-2-4-7-16)19(23)14-20-11-5-8-18(22)13-20/h2-4,6-7,15,17-18,22H,5,8-14H2,1H3
InChIKeyZRTBCKGZWBJRAS-UHFFFAOYSA-N
XLogP2.27
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.44
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]piperazin-1-yl]-N-prop-2-enylacetamide
CID 42923905
2-[4-[2-[benzyl-[(1S)-1-cyclopropylethyl]amino]-2-oxoethyl]piperazin-1-yl]-N-prop-2-enylacetamide
CID 30967227
N-benzyl-N-(1-cyclopropylethyl)-4-hydroxypentanamide
CID 79200111
N-benzyl-N-ethyl-2-[(3R)-3-hydroxypyrrolidin-1-yl]acetamide
CID 78963793
3-amino-N-benzyl-N-(1-cyclopropylethyl)propanamide;hydrochloride
CID 119265819
N-benzyl-N-(1-cyclopropylethyl)pentanamide
CID 78805275
N-benzyl-N-(1-cyclopropylethyl)-2-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]acetamide
CID 45355062
3-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
CID 16610998
1-[2-[benzyl(propan-2-yl)amino]-2-oxoethyl]pyrrolidine-3-carboxylic acid;hydrochloride
CID 119904711
N-benzyl-2-[(3S)-3-hydroxypyrrolidin-1-yl]-N-phenylacetamide
CID 111123187
2-(4-benzoylpiperazin-1-ium-1-yl)-N-benzyl-N-[(1S)-1-cyclopropylethyl]acetamide
CID 8597088
N-benzyl-5-chloro-N-(1-cyclopropylethyl)pentanamide
CID 60948375

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide?
The IUPAC name of N-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide (CID 110879557) is N-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide.
What is the SMILES notation for N-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide?
The canonical SMILES for N-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide is CC(C1CC1)N(Cc1ccccc1)C(=O)CN1CCCC(O)C1.
What is the InChIKey of N-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide?
The InChIKey is ZRTBCKGZWBJRAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O2/c1-15(17-9-10-17)21(12-16-6-3-2-4-7-16)19(23)14-20-11-5-8-18(22)13-20/h2-4,6-7,15,17-18,22H,5,8-14H2,1H3.
What are the key properties of N-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide?
N-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide has a molecular weight of 316.44 g/mol, XLogP of 2.27, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(1-cyclopropylethyl)-2-(3-hydroxypiperidin-1-yl)acetamide is sourced from PubChem (CID 110879557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).