N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide

C15H19IN2O — CID 60730497

IUPACN-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide
SMILESO=C(NC1CCN(C2CC2)CC1)c1ccc(I)cc1
InChIInChI=1S/C15H19IN2O/c16-12-3-1-11(2-4-12)15(19)17-13-7-9-18(10-8-13)14-5-6-14/h1-4,13-14H,5-10H2,(H,17,19)
InChIKeyZCOIDRCSMOVKTO-UHFFFAOYSA-N
MW370.23 g/mol
LogP2.65
Rot. Bonds3

About N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide

N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide (PubChem CID 60730497) has the molecular formula C15H19IN2O and a molecular weight of 370.23 g/mol. Its IUPAC name is N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide.

Molecular Properties

Compound NameN-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide
PubChem CID60730497
Molecular FormulaC15H19IN2O
Molecular Weight370.23 g/mol
Exact Mass370.05
IUPAC NameN-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide
SMILESO=C(NC1CCN(C2CC2)CC1)c1ccc(I)cc1
InChIInChI=1S/C15H19IN2O/c16-12-3-1-11(2-4-12)15(19)17-13-7-9-18(10-8-13)14-5-6-14/h1-4,13-14H,5-10H2,(H,17,19)
InChIKeyZCOIDRCSMOVKTO-UHFFFAOYSA-N
XLogP2.65
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.23
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(1-cyclopropylpiperidin-4-yl)-4-phenylbenzamide
CID 26131227
4-amino-N-(4-piperidin-1-ylcyclohexyl)benzamide
CID 143211763
N-(1-cyclopropylpiperidin-4-yl)-4-(trifluoromethylsulfonyl)benzamide
CID 55567282
N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide
CID 110752030
3-[(4-iodobenzoyl)amino]pyrrolidine-1-carboxylic acid
CID 174192999
4-amino-N-(1-cyclopropylpiperidin-4-yl)-3-methylbenzamide
CID 43711761
N-[1-(cyanomethyl)piperidin-4-yl]-4-iodobenzamide
CID 63627664
N-[1-(2-amino-2-sulfanylideneethyl)piperidin-4-yl]-4-iodobenzamide
CID 63627321
3-bromo-N-(1-cyclopropylpiperidin-4-yl)benzamide
CID 60730541
N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide
CID 41269183
N-(1-cyclopropylpiperidin-4-yl)-4-(3,5-dimethylpyrazol-1-yl)benzamide
CID 86921667
N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide
CID 46548552

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide?
The IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide (CID 60730497) is N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide.
What is the SMILES notation for N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide?
The canonical SMILES for N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide is O=C(NC1CCN(C2CC2)CC1)c1ccc(I)cc1.
What is the InChIKey of N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide?
The InChIKey is ZCOIDRCSMOVKTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19IN2O/c16-12-3-1-11(2-4-12)15(19)17-13-7-9-18(10-8-13)14-5-6-14/h1-4,13-14H,5-10H2,(H,17,19).
What are the key properties of N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide?
N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide has a molecular weight of 370.23 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide is sourced from PubChem (CID 60730497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).