N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide

C17H24N2O — CID 60846421

IUPACN-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide
SMILESO=C(CNC1CCCC1)N(Cc1ccccc1)C1CC1
InChIInChI=1S/C17H24N2O/c20-17(12-18-15-8-4-5-9-15)19(16-10-11-16)13-14-6-2-1-3-7-14/h1-3,6-7,15-16,18H,4-5,8-13H2
InChIKeyQBNVMXLDJCVBOY-UHFFFAOYSA-N
MW272.39 g/mol
LogP2.71
Rot. Bonds6

About N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide

N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide (PubChem CID 60846421) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide.

Molecular Properties

Compound NameN-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide
PubChem CID60846421
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide
SMILESO=C(CNC1CCCC1)N(Cc1ccccc1)C1CC1
InChIInChI=1S/C17H24N2O/c20-17(12-18-15-8-4-5-9-15)19(16-10-11-16)13-14-6-2-1-3-7-14/h1-3,6-7,15-16,18H,4-5,8-13H2
InChIKeyQBNVMXLDJCVBOY-UHFFFAOYSA-N
XLogP2.71
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide?
The IUPAC name of N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide (CID 60846421) is N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide.
What is the SMILES notation for N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide?
The canonical SMILES for N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide is O=C(CNC1CCCC1)N(Cc1ccccc1)C1CC1.
What is the InChIKey of N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide?
The InChIKey is QBNVMXLDJCVBOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c20-17(12-18-15-8-4-5-9-15)19(16-10-11-16)13-14-6-2-1-3-7-14/h1-3,6-7,15-16,18H,4-5,8-13H2.
What are the key properties of N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide?
N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide has a molecular weight of 272.39 g/mol, XLogP of 2.71, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide is sourced from PubChem (CID 60846421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).