N-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide

C14H28N2O — CID 163258053

IUPACN-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide
SMILESCCCN1CCCCC1CN(C(C)=O)C(C)C
InChIInChI=1S/C14H28N2O/c1-5-9-15-10-7-6-8-14(15)11-16(12(2)3)13(4)17/h12,14H,5-11H2,1-4H3
InChIKeyBPQDMLKAHWISMN-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.51
Rot. Bonds5

About N-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide

N-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide (PubChem CID 163258053) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide.

Molecular Properties

Compound NameN-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide
PubChem CID163258053
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide
SMILESCCCN1CCCCC1CN(C(C)=O)C(C)C
InChIInChI=1S/C14H28N2O/c1-5-9-15-10-7-6-8-14(15)11-16(12(2)3)13(4)17/h12,14H,5-11H2,1-4H3
InChIKeyBPQDMLKAHWISMN-UHFFFAOYSA-N
XLogP2.51
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[(2S)-1-(2-hydroxyethyl)piperidin-2-yl]methyl]-N-propan-2-ylacetamide
CID 96554398
N-propan-2-yl-N-[(1-propan-2-ylpiperidin-2-yl)methyl]acetamide
CID 163258628
tert-butyl N-[[1-(2-hydroxyethyl)piperidin-2-yl]methyl]-N-propan-2-ylcarbamate
CID 66566035
2-[2-[(dimethylamino)methyl]piperidin-1-yl]acetamide
CID 14209997
N-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]propan-2-amine
CID 163258347
N-[[(2S)-1-(2-aminoethyl)pyrrolidin-2-yl]methyl]-N-methylacetamide
CID 66567395
2-[2-(aminomethyl)piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 43186999
1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]propan-2-one
CID 62888278
acetic acid;1-butyl-2-ethylpiperidine
CID 175583343
1-[1-[2-(dimethylamino)ethyl]azepan-2-yl]propan-2-ol
CID 114338880
2-[(2-ethylpiperidine-1-carbonyl)-methylamino]propanoic acid
CID 62637552
N-ethyl-N-[[(2S)-1-(2-hydroxyethyl)pyrrolidin-2-yl]methyl]acetamide
CID 66567339

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide?
The IUPAC name of N-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide (CID 163258053) is N-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide.
What is the SMILES notation for N-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide?
The canonical SMILES for N-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide is CCCN1CCCCC1CN(C(C)=O)C(C)C.
What is the InChIKey of N-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide?
The InChIKey is BPQDMLKAHWISMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-5-9-15-10-7-6-8-14(15)11-16(12(2)3)13(4)17/h12,14H,5-11H2,1-4H3.
What are the key properties of N-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide?
N-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide has a molecular weight of 240.39 g/mol, XLogP of 2.51, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-N-[(1-propylpiperidin-2-yl)methyl]acetamide is sourced from PubChem (CID 163258053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).