N-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide

C15H28INO — CID 107322176

IUPACN-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
SMILESCC(C)CC1(C(=O)NCCCCCI)CCCC1
InChIInChI=1S/C15H28INO/c1-13(2)12-15(8-4-5-9-15)14(18)17-11-7-3-6-10-16/h13H,3-12H2,1-2H3,(H,17,18)
InChIKeyZIBDRCXWIXIANS-UHFFFAOYSA-N
MW365.30 g/mol
LogP4.31
Rot. Bonds8

About N-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide

N-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide (PubChem CID 107322176) has the molecular formula C15H28INO and a molecular weight of 365.30 g/mol. Its IUPAC name is N-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
PubChem CID107322176
Molecular FormulaC15H28INO
Molecular Weight365.30 g/mol
Exact Mass365.12
IUPAC NameN-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
SMILESCC(C)CC1(C(=O)NCCCCCI)CCCC1
InChIInChI=1S/C15H28INO/c1-13(2)12-15(8-4-5-9-15)14(18)17-11-7-3-6-10-16/h13H,3-12H2,1-2H3,(H,17,18)
InChIKeyZIBDRCXWIXIANS-UHFFFAOYSA-N
XLogP4.31
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.30
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(5-bromopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 107321660
1-ethyl-N-(4-iodobutyl)cyclopentane-1-carboxamide
CID 106846383
N-[3-(methylamino)propyl]-1-(2-methylpropyl)cyclobutane-1-carboxamide;hydrochloride
CID 119430611
1-(aminomethyl)-N-(7-methyloctyl)cyclohexane-1-carboxamide
CID 115437743
1-(2-methylpropyl)-N-(3-piperazin-1-ylpropyl)cyclobutane-1-carboxamide
CID 119391627
N-[2-methyl-3-(methylamino)propyl]-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 81479281
(2S)-2-hydroxy-3-[[1-(2-methylpropyl)cyclopentanecarbonyl]amino]propanoic acid
CID 107833146
1-ethyl-N-(5-hydroxypentyl)cyclopentane-1-carboxamide
CID 107318578
N-(2-bromo-4-methylpentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 107157722
1-(2-methylpropyl)-N-(2-pyrrolidin-2-ylethyl)cyclopentane-1-carboxamide
CID 114793919
N-(2,2-difluoro-3-hydroxypropyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 104857707
N-[(2S)-1-aminopropan-2-yl]-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 120504549

Frequently Asked Questions

What is the IUPAC name of N-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
The IUPAC name of N-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide (CID 107322176) is N-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for N-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
The canonical SMILES for N-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide is CC(C)CC1(C(=O)NCCCCCI)CCCC1.
What is the InChIKey of N-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
The InChIKey is ZIBDRCXWIXIANS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28INO/c1-13(2)12-15(8-4-5-9-15)14(18)17-11-7-3-6-10-16/h13H,3-12H2,1-2H3,(H,17,18).
What are the key properties of N-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide?
N-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide has a molecular weight of 365.30 g/mol, XLogP of 4.31, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-iodopentyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 107322176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).