N-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide

C12H22N2O2 — CID 62022148

IUPACN-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide
SMILESCN(C(=O)CN1CCCC(CO)C1)C1CC1
InChIInChI=1S/C12H22N2O2/c1-13(11-4-5-11)12(16)8-14-6-2-3-10(7-14)9-15/h10-11,15H,2-9H2,1H3
InChIKeyKQBUBRONGVOFNA-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.31
Rot. Bonds4

About N-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide

N-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide (PubChem CID 62022148) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide
PubChem CID62022148
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide
SMILESCN(C(=O)CN1CCCC(CO)C1)C1CC1
InChIInChI=1S/C12H22N2O2/c1-13(11-4-5-11)12(16)8-14-6-2-3-10(7-14)9-15/h10-11,15H,2-9H2,1H3
InChIKeyKQBUBRONGVOFNA-UHFFFAOYSA-N
XLogP0.31
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]piperidin-3-yl]acetic acid
CID 62690107
N-cyclopropyl-N-methyl-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62546013
CID 59303854
CID 59303854
N-cyclopropyl-2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-methylacetamide
CID 78963664
2-(3-aminoazetidin-1-yl)-N-cyclopropyl-N-methylacetamide
CID 63760735
N-cyclopropyl-2-[2-(hydroxymethyl)morpholin-4-yl]-N-methylacetamide
CID 79833048
2-[(3R)-3-(hydroxymethyl)piperidin-1-yl]-N,N-bis(prop-2-enyl)acetamide
CID 94158736
2-[1-[2-[cyclopropyl(methyl)amino]-2-oxoethyl]azetidin-3-yl]acetic acid
CID 64617338
N-ethyl-2-[3-(hydroxymethyl)piperidin-1-yl]acetamide
CID 60645129
ethyl 4-[3-(hydroxymethyl)piperidin-1-yl]-3-oxobutanoate
CID 63898307
N-cyclopentyl-N-methyl-2-piperazin-1-ylacetamide
CID 43267406
N-cyclopentyl-N-cyclopropyl-2-(3-ethylpiperidin-1-yl)acetamide
CID 78897689

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide?
The IUPAC name of N-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide (CID 62022148) is N-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide.
What is the SMILES notation for N-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide?
The canonical SMILES for N-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide is CN(C(=O)CN1CCCC(CO)C1)C1CC1.
What is the InChIKey of N-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide?
The InChIKey is KQBUBRONGVOFNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-13(11-4-5-11)12(16)8-14-6-2-3-10(7-14)9-15/h10-11,15H,2-9H2,1H3.
What are the key properties of N-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide?
N-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide has a molecular weight of 226.32 g/mol, XLogP of 0.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[3-(hydroxymethyl)piperidin-1-yl]-N-methylacetamide is sourced from PubChem (CID 62022148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).