N-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide

C16H26N2O2 — CID 99775405

IUPACN-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(C(=O)[C@@H]2C[C@@H]2C2CCC2)CC1
InChIInChI=1S/C16H26N2O2/c1-11(19)17-10-12-5-7-18(8-6-12)16(20)15-9-14(15)13-3-2-4-13/h12-15H,2-10H2,1H3,(H,17,19)/t14-,15-/m1/s1
InChIKeyGWPQUCYWAGKSQU-HUUCEWRRSA-N
MW278.40 g/mol
LogP1.80
Rot. Bonds4

About N-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide

N-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide (PubChem CID 99775405) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide
PubChem CID99775405
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(C(=O)[C@@H]2C[C@@H]2C2CCC2)CC1
InChIInChI=1S/C16H26N2O2/c1-11(19)17-10-12-5-7-18(8-6-12)16(20)15-9-14(15)13-3-2-4-13/h12-15H,2-10H2,1H3,(H,17,19)/t14-,15-/m1/s1
InChIKeyGWPQUCYWAGKSQU-HUUCEWRRSA-N
XLogP1.80
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide?
The IUPAC name of N-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide (CID 99775405) is N-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide.
What is the SMILES notation for N-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide?
The canonical SMILES for N-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide is CC(=O)NCC1CCN(C(=O)[C@@H]2C[C@@H]2C2CCC2)CC1.
What is the InChIKey of N-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide?
The InChIKey is GWPQUCYWAGKSQU-HUUCEWRRSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-11(19)17-10-12-5-7-18(8-6-12)16(20)15-9-14(15)13-3-2-4-13/h12-15H,2-10H2,1H3,(H,17,19)/t14-,15-/m1/s1.
What are the key properties of N-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide?
N-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide has a molecular weight of 278.40 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[(1R,2R)-2-cyclobutylcyclopropanecarbonyl]piperidin-4-yl]methyl]acetamide is sourced from PubChem (CID 99775405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).