N-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide

C12H22N2O — CID 112541640

IUPACN-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide
SMILESCC(=O)NC1CC(CC2CC2)CN(C)C1
InChIInChI=1S/C12H22N2O/c1-9(15)13-12-6-11(5-10-3-4-10)7-14(2)8-12/h10-12H,3-8H2,1-2H3,(H,13,15)
InChIKeyUGPWNRBALGJWEB-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.24
Rot. Bonds3

About N-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide

N-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide (PubChem CID 112541640) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is N-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide
PubChem CID112541640
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC NameN-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide
SMILESCC(=O)NC1CC(CC2CC2)CN(C)C1
InChIInChI=1S/C12H22N2O/c1-9(15)13-12-6-11(5-10-3-4-10)7-14(2)8-12/h10-12H,3-8H2,1-2H3,(H,13,15)
InChIKeyUGPWNRBALGJWEB-UHFFFAOYSA-N
XLogP1.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]-2,2-dimethylpropanamide
CID 112542085
5-(cyclopropylmethyl)-N,1-dimethylpiperidin-3-amine
CID 83989521
N-[5-(cyclopropylmethyl)-1-(2-methylpropanoyl)piperidin-3-yl]acetamide
CID 112541864
N-[1-(1-cyclopropylethyl)-5-(cyclopropylmethyl)piperidin-3-yl]acetamide
CID 112541988
N-[5-(cyclopropylmethyl)-1-propylpiperidin-3-yl]-2,2-dimethylpropanamide
CID 112542144
N-(cyclohexylmethyl)-5-(cyclopropylmethyl)-1-methylpiperidin-3-amine
CID 83998283
N-[1-(cyclopropylmethyl)-5-ethylpiperidin-3-yl]acetamide
CID 112541972
ethane;methoxymethane;N-(1-methylpyrrolidin-3-yl)acetamide
CID 169257856
2-(3-acetamidocyclobutyl)acetic acid
CID 154928575
methyl 3-(cyclopropylmethyl)-5-(2,2-dimethylpropanoylamino)piperidine-1-carboxylate
CID 112542210
methyl N-[1,5-bis(cyclopropylmethyl)piperidin-3-yl]carbamate
CID 112543412
2-[5-(cyclopropylmethylamino)-1-methylpiperidin-3-yl]acetic acid
CID 83996220

Frequently Asked Questions

What is the IUPAC name of N-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide?
The IUPAC name of N-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide (CID 112541640) is N-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide.
What is the SMILES notation for N-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide?
The canonical SMILES for N-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide is CC(=O)NC1CC(CC2CC2)CN(C)C1.
What is the InChIKey of N-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide?
The InChIKey is UGPWNRBALGJWEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-9(15)13-12-6-11(5-10-3-4-10)7-14(2)8-12/h10-12H,3-8H2,1-2H3,(H,13,15).
What are the key properties of N-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide?
N-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide has a molecular weight of 210.32 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(cyclopropylmethyl)-1-methylpiperidin-3-yl]acetamide is sourced from PubChem (CID 112541640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).