N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide

C13H25NO2 — CID 56823316

IUPACN-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide
SMILESCC(C)COCC(C)NC(=O)C1CCCC1
InChIInChI=1S/C13H25NO2/c1-10(2)8-16-9-11(3)14-13(15)12-6-4-5-7-12/h10-12H,4-9H2,1-3H3,(H,14,15)
InChIKeyROZAQOPQBLNZRC-UHFFFAOYSA-N
MW227.35 g/mol
LogP2.35
Rot. Bonds6

About N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide

N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide (PubChem CID 56823316) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide
PubChem CID56823316
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC NameN-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide
SMILESCC(C)COCC(C)NC(=O)C1CCCC1
InChIInChI=1S/C13H25NO2/c1-10(2)8-16-9-11(3)14-13(15)12-6-4-5-7-12/h10-12H,4-9H2,1-3H3,(H,14,15)
InChIKeyROZAQOPQBLNZRC-UHFFFAOYSA-N
XLogP2.35
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1S,2R)-N-[(2S)-1-(2-methylpropoxy)propan-2-yl]-2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 129424835
N-pent-4-yn-2-ylcyclopentanecarboxamide
CID 115661776
N-butan-2-ylcyclooctanecarboxamide
CID 65022908
N-pentan-2-ylcyclohexanecarboxamide
CID 19916603
(3R)-3-(cyclohexanecarbonylamino)butanoic acid
CID 51885508
N-(1-hydroxypropan-2-yl)cyclobutanecarboxamide
CID 43418906
N-heptan-2-ylcyclopentanecarboxamide
CID 5012700
N-(5-aminohexan-2-yl)cyclohexanecarboxamide
CID 134308456
N-hexan-2-ylcyclohexanecarboxamide
CID 174494551
methyl (3S)-3-[[(3R)-3-(cyclopentanecarbonylamino)butanoyl]amino]butanoate
CID 95609074
N-(4-methylpentan-2-yl)cyclopropanecarboxamide
CID 64592829
1-cyclohexyl-2-(2-methylpropoxy)ethanone
CID 104751697

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide?
The IUPAC name of N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide (CID 56823316) is N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide?
The canonical SMILES for N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide is CC(C)COCC(C)NC(=O)C1CCCC1.
What is the InChIKey of N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide?
The InChIKey is ROZAQOPQBLNZRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-10(2)8-16-9-11(3)14-13(15)12-6-4-5-7-12/h10-12H,4-9H2,1-3H3,(H,14,15).
What are the key properties of N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide?
N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide has a molecular weight of 227.35 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanecarboxamide is sourced from PubChem (CID 56823316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).