N-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide

C11H20F2N2O — CID 103515070

IUPACN-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide
SMILESCCCCN1CCC(NC(=O)C(F)F)CC1
InChIInChI=1S/C11H20F2N2O/c1-2-3-6-15-7-4-9(5-8-15)14-11(16)10(12)13/h9-10H,2-8H2,1H3,(H,14,16)
InChIKeySVLHDLOWRFENKP-UHFFFAOYSA-N
MW234.29 g/mol
LogP1.63
Rot. Bonds5

About N-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide

N-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide (PubChem CID 103515070) has the molecular formula C11H20F2N2O and a molecular weight of 234.29 g/mol. Its IUPAC name is N-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide.

Molecular Properties

Compound NameN-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide
PubChem CID103515070
Molecular FormulaC11H20F2N2O
Molecular Weight234.29 g/mol
Exact Mass234.15
IUPAC NameN-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide
SMILESCCCCN1CCC(NC(=O)C(F)F)CC1
InChIInChI=1S/C11H20F2N2O/c1-2-3-6-15-7-4-9(5-8-15)14-11(16)10(12)13/h9-10H,2-8H2,1H3,(H,14,16)
InChIKeySVLHDLOWRFENKP-UHFFFAOYSA-N
XLogP1.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.29
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-butylpiperidin-4-yl)acetamide
CID 21136025
N-(1-butylpiperidin-4-yl)-2,2,3,3-tetrafluoropropanamide
CID 103733678
(2S)-2-amino-N-(1-butylpiperidin-4-yl)-3-methylpentanamide
CID 61173353
N-(1-butylpiperidin-4-yl)-4-hydroxypentanamide
CID 79205186
1-(1-butylpiperidin-4-yl)-3-(2-hydroxyethyl)urea
CID 110911531
2-hydroxyethyl N-(1-butylpiperidin-4-yl)carbamate
CID 79345508
2-amino-N-(1-butylpiperidin-4-yl)-2-(4-methylphenyl)acetamide
CID 120670008
N-(1-butylpiperidin-4-yl)-4-(hydroxymethyl)piperidine-1-carboxamide
CID 110911537
N-(1-butylpiperidin-4-yl)-2-(prop-2-ynylamino)acetamide
CID 79287721
(2R)-2-amino-N-(1-propylpiperidin-4-yl)propanamide;dihydrochloride
CID 119834920
(2S)-2-amino-N-(1-propylpiperidin-4-yl)propanamide;dihydrochloride
CID 119834930
5-[(1-butylpiperidin-4-yl)amino]-3,3-dimethyl-5-oxopentanoic acid
CID 62935081

Frequently Asked Questions

What is the IUPAC name of N-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide?
The IUPAC name of N-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide (CID 103515070) is N-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide.
What is the SMILES notation for N-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide?
The canonical SMILES for N-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide is CCCCN1CCC(NC(=O)C(F)F)CC1.
What is the InChIKey of N-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide?
The InChIKey is SVLHDLOWRFENKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F2N2O/c1-2-3-6-15-7-4-9(5-8-15)14-11(16)10(12)13/h9-10H,2-8H2,1H3,(H,14,16).
What are the key properties of N-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide?
N-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide has a molecular weight of 234.29 g/mol, XLogP of 1.63, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-butylpiperidin-4-yl)-2,2-difluoroacetamide is sourced from PubChem (CID 103515070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).