N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide

C15H27N3O3 — CID 62356308

IUPACN-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide
SMILESCN(CC(=O)NC1CC1)C(=O)CN1CCCC(CCO)C1
InChIInChI=1S/C15H27N3O3/c1-17(10-14(20)16-13-4-5-13)15(21)11-18-7-2-3-12(9-18)6-8-19/h12-13,19H,2-11H2,1H3,(H,16,20)
InChIKeyOMLLXJLJZKVPFE-UHFFFAOYSA-N
MW297.40 g/mol
LogP-0.18
Rot. Bonds7

About N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide

N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide (PubChem CID 62356308) has the molecular formula C15H27N3O3 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide.

Molecular Properties

Compound NameN-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide
PubChem CID62356308
Molecular FormulaC15H27N3O3
Molecular Weight297.40 g/mol
Exact Mass297.21
IUPAC NameN-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide
SMILESCN(CC(=O)NC1CC1)C(=O)CN1CCCC(CCO)C1
InChIInChI=1S/C15H27N3O3/c1-17(10-14(20)16-13-4-5-13)15(21)11-18-7-2-3-12(9-18)6-8-19/h12-13,19H,2-11H2,1H3,(H,16,20)
InChIKeyOMLLXJLJZKVPFE-UHFFFAOYSA-N
XLogP-0.18
TPSA72.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide
CID 63267509
N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-piperazin-1-ylacetamide
CID 43162383
2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
CID 81451259
2-[[3-(2-hydroxyethyl)piperidin-1-yl]methyl]prop-2-enoic acid
CID 107227868
2-[4-(1-aminoethyl)piperidin-1-yl]-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
CID 63595362
2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide
CID 62356455
ethyl 2-[3-(2-hydroxyethyl)piperidin-1-yl]acetate
CID 62356988
2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methyl-N-(thiophen-3-ylmethyl)acetamide
CID 62357316
N-(tert-butylcarbamoyl)-2-[3-(2-hydroxyethyl)piperidin-1-yl]acetamide
CID 62357321
2-[[2-[bis(2-hydroxyethyl)amino]acetyl]-methylamino]-N-cyclopropylacetamide
CID 60686591
N-(cyclopentylcarbamoyl)-2-[3-(2-hydroxyethyl)pyrrolidin-1-yl]acetamide
CID 115647897
2-(4-amino-2-methylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
CID 115313084

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide?
The IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide (CID 62356308) is N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide.
What is the SMILES notation for N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide?
The canonical SMILES for N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide is CN(CC(=O)NC1CC1)C(=O)CN1CCCC(CCO)C1.
What is the InChIKey of N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide?
The InChIKey is OMLLXJLJZKVPFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O3/c1-17(10-14(20)16-13-4-5-13)15(21)11-18-7-2-3-12(9-18)6-8-19/h12-13,19H,2-11H2,1H3,(H,16,20).
What are the key properties of N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide?
N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide has a molecular weight of 297.40 g/mol, XLogP of -0.18, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide is sourced from PubChem (CID 62356308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).