N-cyclopropyl-3-(cyclopropylamino)benzamide

C13H16N2O — CID 103438850

IUPACN-cyclopropyl-3-(cyclopropylamino)benzamide
SMILESO=C(NC1CC1)c1cccc(NC2CC2)c1
InChIInChI=1S/C13H16N2O/c16-13(15-11-6-7-11)9-2-1-3-12(8-9)14-10-4-5-10/h1-3,8,10-11,14H,4-7H2,(H,15,16)
InChIKeyLXWYYEGSTJRSCR-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.15
Rot. Bonds4

About N-cyclopropyl-3-(cyclopropylamino)benzamide

N-cyclopropyl-3-(cyclopropylamino)benzamide (PubChem CID 103438850) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is N-cyclopropyl-3-(cyclopropylamino)benzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(cyclopropylamino)benzamide
PubChem CID103438850
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC NameN-cyclopropyl-3-(cyclopropylamino)benzamide
SMILESO=C(NC1CC1)c1cccc(NC2CC2)c1
InChIInChI=1S/C13H16N2O/c16-13(15-11-6-7-11)9-2-1-3-12(8-9)14-10-4-5-10/h1-3,8,10-11,14H,4-7H2,(H,15,16)
InChIKeyLXWYYEGSTJRSCR-UHFFFAOYSA-N
XLogP2.15
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(carbamoylamino)-N-cyclopropylbenzamide
CID 9210111
3-acetamido-N-(4-hydroxycyclohexyl)benzamide
CID 43389328
3-(cyclopropanecarbonylamino)-N-[3-(cyclopropylcarbamoyl)phenyl]benzamide
CID 30127139
3-acetamido-N-[4-[[2,6-bis(trifluoromethyl)-4-pyridinyl]amino]cyclohexyl]benzamide
CID 163399498
N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide
CID 16567528
N-methyl-3-[(4-propan-2-ylcyclohexyl)amino]benzamide
CID 62702969
N-cyclohexyl-3-(methoxyamino)benzamide
CID 142229646
3-(benzenesulfonamido)-N-cyclopropylbenzamide
CID 17465618
3-[(4-tert-butylbenzoyl)amino]-N-cyclopropylbenzamide
CID 26110808
methyl 3-[[3-(cyclopropylcarbamoyl)benzoyl]amino]benzoate
CID 109050811
3-[[(2S)-2-aminopropanoyl]amino]-N-cyclopropylbenzamide
CID 78969031
3-[(2-cyanoacetyl)amino]-N-cyclopropylbenzamide
CID 168520744

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(cyclopropylamino)benzamide?
The IUPAC name of N-cyclopropyl-3-(cyclopropylamino)benzamide (CID 103438850) is N-cyclopropyl-3-(cyclopropylamino)benzamide.
What is the SMILES notation for N-cyclopropyl-3-(cyclopropylamino)benzamide?
The canonical SMILES for N-cyclopropyl-3-(cyclopropylamino)benzamide is O=C(NC1CC1)c1cccc(NC2CC2)c1.
What is the InChIKey of N-cyclopropyl-3-(cyclopropylamino)benzamide?
The InChIKey is LXWYYEGSTJRSCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c16-13(15-11-6-7-11)9-2-1-3-12(8-9)14-10-4-5-10/h1-3,8,10-11,14H,4-7H2,(H,15,16).
What are the key properties of N-cyclopropyl-3-(cyclopropylamino)benzamide?
N-cyclopropyl-3-(cyclopropylamino)benzamide has a molecular weight of 216.28 g/mol, XLogP of 2.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(cyclopropylamino)benzamide is sourced from PubChem (CID 103438850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).