2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide

C15H19ClN2O2 — CID 106599315

IUPAC2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide
SMILESO=C(c1cc(O)ccc1Cl)N(CC1CCCN1)C1CC1
InChIInChI=1S/C15H19ClN2O2/c16-14-6-5-12(19)8-13(14)15(20)18(11-3-4-11)9-10-2-1-7-17-10/h5-6,8,10-11,17,19H,1-4,7,9H2
InChIKeyFIFZMBRXZFPYIX-UHFFFAOYSA-N
MW294.78 g/mol
LogP2.40
Rot. Bonds4

About 2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide

2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide (PubChem CID 106599315) has the molecular formula C15H19ClN2O2 and a molecular weight of 294.78 g/mol. Its IUPAC name is 2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide
PubChem CID106599315
Molecular FormulaC15H19ClN2O2
Molecular Weight294.78 g/mol
Exact Mass294.11
IUPAC Name2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide
SMILESO=C(c1cc(O)ccc1Cl)N(CC1CCCN1)C1CC1
InChIInChI=1S/C15H19ClN2O2/c16-14-6-5-12(19)8-13(14)15(20)18(11-3-4-11)9-10-2-1-7-17-10/h5-6,8,10-11,17,19H,1-4,7,9H2
InChIKeyFIFZMBRXZFPYIX-UHFFFAOYSA-N
XLogP2.40
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.78
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2,5-dihydroxy-N-(piperidin-2-ylmethyl)benzamide
CID 107725344
2-chloro-5-hydroxy-N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106611521
4-chloro-N-cyclopropyl-2-fluoro-N-(piperidin-2-ylmethyl)benzamide
CID 106626825
2-bromo-N-cyclopropyl-N-(pyrrolidin-2-ylmethyl)furan-3-carboxamide
CID 106855243
5-chloro-N-cyclopropyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide
CID 104974058
5-bromo-2-chloro-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106607717
N-cyclopropyl-2-hydroxy-4-methyl-N-(piperidin-2-ylmethyl)benzamide
CID 106627042
2-chloro-N-cyclohexyl-5-hydroxy-N-(2-hydroxyethyl)benzamide
CID 106501618
N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide
CID 106599374
2,5-dihydroxy-N-(2-hydroxyethyl)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 107725339
5-bromo-2-chloro-N-ethyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106609221
2-bromo-N-cyclopropyl-3-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 107983259

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide?
The IUPAC name of 2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide (CID 106599315) is 2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide.
What is the SMILES notation for 2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide?
The canonical SMILES for 2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide is O=C(c1cc(O)ccc1Cl)N(CC1CCCN1)C1CC1.
What is the InChIKey of 2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide?
The InChIKey is FIFZMBRXZFPYIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O2/c16-14-6-5-12(19)8-13(14)15(20)18(11-3-4-11)9-10-2-1-7-17-10/h5-6,8,10-11,17,19H,1-4,7,9H2.
What are the key properties of 2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide?
2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide has a molecular weight of 294.78 g/mol, XLogP of 2.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-cyclopropyl-5-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide is sourced from PubChem (CID 106599315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).