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

C12H24N2O — CID 145081449

IUPACN-methyl-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]formamide
SMILESCC(C)N1CCC(CCN(C)C=O)CC1
InChIInChI=1S/C12H24N2O/c1-11(2)14-8-5-12(6-9-14)4-7-13(3)10-15/h10-12H,4-9H2,1-3H3
InChIKeyABNPKMVXUHPQNL-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.59
Rot. Bonds5

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

N-methyl-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]formamide (PubChem CID 145081449) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-methyl-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]formamide.

Molecular Properties

Compound NameN-methyl-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]formamide
PubChem CID145081449
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-methyl-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]formamide
SMILESCC(C)N1CCC(CCN(C)C=O)CC1
InChIInChI=1S/C12H24N2O/c1-11(2)14-8-5-12(6-9-14)4-7-13(3)10-15/h10-12H,4-9H2,1-3H3
InChIKeyABNPKMVXUHPQNL-UHFFFAOYSA-N
XLogP1.59
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.59
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-(1-propan-2-ylpiperidin-4-yl)ethyl]formamide?
The IUPAC name of N-methyl-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]formamide (CID 145081449) is N-methyl-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]formamide.
What is the SMILES notation for N-methyl-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]formamide?
The canonical SMILES for N-methyl-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]formamide is CC(C)N1CCC(CCN(C)C=O)CC1.
What is the InChIKey of N-methyl-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]formamide?
The InChIKey is ABNPKMVXUHPQNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-11(2)14-8-5-12(6-9-14)4-7-13(3)10-15/h10-12H,4-9H2,1-3H3.
What are the key properties of N-methyl-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]formamide?
N-methyl-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]formamide has a molecular weight of 212.34 g/mol, XLogP of 1.59, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]formamide is sourced from PubChem (CID 145081449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).