N-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide

C23H33N3O2 — CID 4265195

IUPACN-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide
SMILESCC1CCN(c2ccc(NC(=O)C3CC3)cc2C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C23H33N3O2/c1-16-11-13-26(14-12-16)21-10-9-19(25-22(27)17-7-8-17)15-20(21)23(28)24-18-5-3-2-4-6-18/h9-10,15-18H,2-8,11-14H2,1H3,(H,24,28)(H,25,27)
InChIKeyUPRKEWSFRQQNPD-UHFFFAOYSA-N
MW383.54 g/mol
LogP4.33
Rot. Bonds5

About N-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide

N-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide (PubChem CID 4265195) has the molecular formula C23H33N3O2 and a molecular weight of 383.54 g/mol. Its IUPAC name is N-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide.

Molecular Properties

Compound NameN-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide
PubChem CID4265195
Molecular FormulaC23H33N3O2
Molecular Weight383.54 g/mol
Exact Mass383.26
IUPAC NameN-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide
SMILESCC1CCN(c2ccc(NC(=O)C3CC3)cc2C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C23H33N3O2/c1-16-11-13-26(14-12-16)21-10-9-19(25-22(27)17-7-8-17)15-20(21)23(28)24-18-5-3-2-4-6-18/h9-10,15-18H,2-8,11-14H2,1H3,(H,24,28)(H,25,27)
InChIKeyUPRKEWSFRQQNPD-UHFFFAOYSA-N
XLogP4.33
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.54
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

5-acetamido-N-cyclopropyl-2-(4-methylpiperidin-1-yl)benzamide
CID 42757156
N-cyclohexyl-5-[(2,4-dichlorobenzoyl)amino]-2-(4-methylpiperidin-1-yl)benzamide
CID 3299631
N-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide
CID 42752860
N-cyclohexyl-5-[(2,4-dimethoxybenzoyl)amino]-2-(4-methylpiperidin-1-yl)benzamide
CID 3643543
5-(cyclobutanecarbonylamino)-N-(2-methoxyethyl)-2-(4-methylpiperidin-1-yl)benzamide
CID 42757193
5-(cyclohexanecarbonylamino)-2-(4-methylpiperidin-1-yl)-N-(1-phenylethyl)benzamide
CID 3689209
5-[[(2S)-2-chloropropanoyl]amino]-N-cyclohexyl-2-pyrrolidin-1-ylbenzamide
CID 1064488
5-(tert-butylcarbamoylamino)-N-cyclohexyl-2-pyrrolidin-1-ylbenzamide
CID 42752999
5-(cyclobutanecarbonylamino)-2-(4-methylpiperidin-1-yl)-N-(2-methylpropyl)benzamide
CID 1063157
5-benzamido-N-cyclohexyl-2-pyrrolidin-1-ylbenzamide
CID 1064478
5-(cyclobutanecarbonylamino)-N-(3-methoxypropyl)-2-(4-methylpiperidin-1-yl)benzamide
CID 42752967
5-[(4-chlorobenzoyl)amino]-N-cyclohexyl-2-pyrrolidin-1-ylbenzamide
CID 1064480

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide?
The IUPAC name of N-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide (CID 4265195) is N-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide.
What is the SMILES notation for N-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide?
The canonical SMILES for N-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide is CC1CCN(c2ccc(NC(=O)C3CC3)cc2C(=O)NC2CCCCC2)CC1.
What is the InChIKey of N-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide?
The InChIKey is UPRKEWSFRQQNPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H33N3O2/c1-16-11-13-26(14-12-16)21-10-9-19(25-22(27)17-7-8-17)15-20(21)23(28)24-18-5-3-2-4-6-18/h9-10,15-18H,2-8,11-14H2,1H3,(H,24,28)(H,25,27).
What are the key properties of N-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide?
N-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide has a molecular weight of 383.54 g/mol, XLogP of 4.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-(cyclopropanecarbonylamino)-2-(4-methylpiperidin-1-yl)benzamide is sourced from PubChem (CID 4265195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).