3-chloro-N-(dicyclopropylmethyl)benzamide

C14H16ClNO — CID 18153337

IUPAC3-chloro-N-(dicyclopropylmethyl)benzamide
SMILESO=C(NC(C1CC1)C1CC1)c1cccc(Cl)c1
InChIInChI=1S/C14H16ClNO/c15-12-3-1-2-11(8-12)14(17)16-13(9-4-5-9)10-6-7-10/h1-3,8-10,13H,4-7H2,(H,16,17)
InChIKeyMXIYJKVHSWXGCC-UHFFFAOYSA-N
MW249.74 g/mol
LogP3.26
Rot. Bonds4

About 3-chloro-N-(dicyclopropylmethyl)benzamide

3-chloro-N-(dicyclopropylmethyl)benzamide (PubChem CID 18153337) has the molecular formula C14H16ClNO and a molecular weight of 249.74 g/mol. Its IUPAC name is 3-chloro-N-(dicyclopropylmethyl)benzamide.

Molecular Properties

Compound Name3-chloro-N-(dicyclopropylmethyl)benzamide
PubChem CID18153337
Molecular FormulaC14H16ClNO
Molecular Weight249.74 g/mol
Exact Mass249.09
IUPAC Name3-chloro-N-(dicyclopropylmethyl)benzamide
SMILESO=C(NC(C1CC1)C1CC1)c1cccc(Cl)c1
InChIInChI=1S/C14H16ClNO/c15-12-3-1-2-11(8-12)14(17)16-13(9-4-5-9)10-6-7-10/h1-3,8-10,13H,4-7H2,(H,16,17)
InChIKeyMXIYJKVHSWXGCC-UHFFFAOYSA-N
XLogP3.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.74
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(3-chlorobenzoyl)amino]-2-cyclopropylacetic acid
CID 55108280
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CID 114315975
3-chloro-N-[cyano(cyclohexyl)methyl]benzamide
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2,6-dichloro-N-(dicyclopropylmethyl)pyridine-4-carboxamide
CID 47020007
3-chloro-N-(3-oxobutan-2-yl)benzamide
CID 64997142
N-(1-amino-1-oxopropan-2-yl)-3-chlorobenzamide
CID 54104367
N-(dicyclopropylmethyl)-3-(tetrazol-1-yl)benzamide
CID 25492900
2-(4-chlorobenzoyl)-N-(dicyclopropylmethyl)benzamide
CID 55536405
3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide
CID 1369981
2-[(3-chlorobenzoyl)amino]-3-hydroxypropanoic acid
CID 4135322
(2S)-2-[(3-chlorobenzoyl)amino]-3-hydroxypropanoic acid
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Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(dicyclopropylmethyl)benzamide?
The IUPAC name of 3-chloro-N-(dicyclopropylmethyl)benzamide (CID 18153337) is 3-chloro-N-(dicyclopropylmethyl)benzamide.
What is the SMILES notation for 3-chloro-N-(dicyclopropylmethyl)benzamide?
The canonical SMILES for 3-chloro-N-(dicyclopropylmethyl)benzamide is O=C(NC(C1CC1)C1CC1)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-(dicyclopropylmethyl)benzamide?
The InChIKey is MXIYJKVHSWXGCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClNO/c15-12-3-1-2-11(8-12)14(17)16-13(9-4-5-9)10-6-7-10/h1-3,8-10,13H,4-7H2,(H,16,17).
What are the key properties of 3-chloro-N-(dicyclopropylmethyl)benzamide?
3-chloro-N-(dicyclopropylmethyl)benzamide has a molecular weight of 249.74 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(dicyclopropylmethyl)benzamide is sourced from PubChem (CID 18153337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).