N-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide

C10H20N2O — CID 118069129

IUPACN-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide
SMILESCC1CCN(CCN(C)C=O)CC1
InChIInChI=1S/C10H20N2O/c1-10-3-5-12(6-4-10)8-7-11(2)9-13/h9-10H,3-8H2,1-2H3
InChIKeyKJPHSFBIQROJAR-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.81
Rot. Bonds4

About N-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide

N-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide (PubChem CID 118069129) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide.

Molecular Properties

Compound NameN-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide
PubChem CID118069129
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide
SMILESCC1CCN(CCN(C)C=O)CC1
InChIInChI=1S/C10H20N2O/c1-10-3-5-12(6-4-10)8-7-11(2)9-13/h9-10H,3-8H2,1-2H3
InChIKeyKJPHSFBIQROJAR-UHFFFAOYSA-N
XLogP0.81
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide?
The IUPAC name of N-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide (CID 118069129) is N-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide.
What is the SMILES notation for N-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide?
The canonical SMILES for N-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide is CC1CCN(CCN(C)C=O)CC1.
What is the InChIKey of N-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide?
The InChIKey is KJPHSFBIQROJAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-10-3-5-12(6-4-10)8-7-11(2)9-13/h9-10H,3-8H2,1-2H3.
What are the key properties of N-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide?
N-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide has a molecular weight of 184.28 g/mol, XLogP of 0.81, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]formamide is sourced from PubChem (CID 118069129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).