N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide

C17H26N2O2 — CID 63122159

IUPACN,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide
SMILESCC1CC1c1ccc(CN(C)C(=O)C2(C)CCNCC2)o1
InChIInChI=1S/C17H26N2O2/c1-12-10-14(12)15-5-4-13(21-15)11-19(3)16(20)17(2)6-8-18-9-7-17/h4-5,12,14,18H,6-11H2,1-3H3
InChIKeyHATJXBRGPWCBQJ-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.75
Rot. Bonds4

About N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide

N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide (PubChem CID 63122159) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide
PubChem CID63122159
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide
SMILESCC1CC1c1ccc(CN(C)C(=O)C2(C)CCNCC2)o1
InChIInChI=1S/C17H26N2O2/c1-12-10-14(12)15-5-4-13(21-15)11-19(3)16(20)17(2)6-8-18-9-7-17/h4-5,12,14,18H,6-11H2,1-3H3
InChIKeyHATJXBRGPWCBQJ-UHFFFAOYSA-N
XLogP2.75
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide?
The IUPAC name of N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide (CID 63122159) is N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide.
What is the SMILES notation for N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide?
The canonical SMILES for N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide is CC1CC1c1ccc(CN(C)C(=O)C2(C)CCNCC2)o1.
What is the InChIKey of N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide?
The InChIKey is HATJXBRGPWCBQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-12-10-14(12)15-5-4-13(21-15)11-19(3)16(20)17(2)6-8-18-9-7-17/h4-5,12,14,18H,6-11H2,1-3H3.
What are the key properties of N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide?
N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide is sourced from PubChem (CID 63122159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).