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

C11H22N2O — CID 87600022

IUPACN-[2-(1-propylpiperidin-4-yl)ethyl]formamide
SMILESCCCN1CCC(CCNC=O)CC1
InChIInChI=1S/C11H22N2O/c1-2-7-13-8-4-11(5-9-13)3-6-12-10-14/h10-11H,2-9H2,1H3,(H,12,14)
InChIKeyCBFLNISUUMUBAE-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.24
Rot. Bonds6

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

N-[2-(1-propylpiperidin-4-yl)ethyl]formamide (PubChem CID 87600022) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N-[2-(1-propylpiperidin-4-yl)ethyl]formamide.

Molecular Properties

Compound NameN-[2-(1-propylpiperidin-4-yl)ethyl]formamide
PubChem CID87600022
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN-[2-(1-propylpiperidin-4-yl)ethyl]formamide
SMILESCCCN1CCC(CCNC=O)CC1
InChIInChI=1S/C11H22N2O/c1-2-7-13-8-4-11(5-9-13)3-6-12-10-14/h10-11H,2-9H2,1H3,(H,12,14)
InChIKeyCBFLNISUUMUBAE-UHFFFAOYSA-N
XLogP1.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1-propylpiperidin-4-yl)ethyl]formamide?
The IUPAC name of N-[2-(1-propylpiperidin-4-yl)ethyl]formamide (CID 87600022) is N-[2-(1-propylpiperidin-4-yl)ethyl]formamide.
What is the SMILES notation for N-[2-(1-propylpiperidin-4-yl)ethyl]formamide?
The canonical SMILES for N-[2-(1-propylpiperidin-4-yl)ethyl]formamide is CCCN1CCC(CCNC=O)CC1.
What is the InChIKey of N-[2-(1-propylpiperidin-4-yl)ethyl]formamide?
The InChIKey is CBFLNISUUMUBAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-2-7-13-8-4-11(5-9-13)3-6-12-10-14/h10-11H,2-9H2,1H3,(H,12,14).
What are the key properties of N-[2-(1-propylpiperidin-4-yl)ethyl]formamide?
N-[2-(1-propylpiperidin-4-yl)ethyl]formamide has a molecular weight of 198.31 g/mol, XLogP of 1.24, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-propylpiperidin-4-yl)ethyl]formamide is sourced from PubChem (CID 87600022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).