N-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide

C17H23FN2O — CID 106608292

IUPACN-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)N(CC1CC1)CC1CCCN1
InChIInChI=1S/C17H23FN2O/c18-15-7-5-13(6-8-15)10-17(21)20(11-14-3-4-14)12-16-2-1-9-19-16/h5-8,14,16,19H,1-4,9-12H2
InChIKeyJLQYODQDINXLSQ-UHFFFAOYSA-N
MW290.38 g/mol
LogP2.36
Rot. Bonds6

About N-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide

N-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide (PubChem CID 106608292) has the molecular formula C17H23FN2O and a molecular weight of 290.38 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide
PubChem CID106608292
Molecular FormulaC17H23FN2O
Molecular Weight290.38 g/mol
Exact Mass290.18
IUPAC NameN-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)N(CC1CC1)CC1CCCN1
InChIInChI=1S/C17H23FN2O/c18-15-7-5-13(6-8-15)10-17(21)20(11-14-3-4-14)12-16-2-1-9-19-16/h5-8,14,16,19H,1-4,9-12H2
InChIKeyJLQYODQDINXLSQ-UHFFFAOYSA-N
XLogP2.36
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.38
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopropylmethyl)-2-phenyl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106608735
N-(cyclopropylmethyl)-2-pyridin-3-yl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106608618
N-cyclopropyl-2-(4-fluorophenyl)-N-(piperidin-2-ylmethyl)acetamide
CID 106626819
N-(2-hydroxyethyl)-2-(4-methylphenyl)-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106612681
N-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-prop-2-ynylacetamide
CID 113330077
1-(4-fluorophenyl)-3-pyrrolidin-2-ylpropan-2-one
CID 116560826
5-chloro-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)furan-2-carboxamide
CID 106608722
N-ethyl-2-(3-fluorophenyl)-N-(piperidin-2-ylmethyl)acetamide
CID 106626297
2-cycloheptyl-N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106608336
N-(cyclopropylmethyl)-5-methyl-N-(pyrrolidin-2-ylmethyl)furan-2-carboxamide
CID 106608715
N-(2-hydroxyethyl)-2-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106612506
N-[(4-fluorophenyl)methyl]-N-methyl-1-pyrrolidin-2-ylmethanamine
CID 61412988

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide (CID 106608292) is N-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide is O=C(Cc1ccc(F)cc1)N(CC1CC1)CC1CCCN1.
What is the InChIKey of N-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide?
The InChIKey is JLQYODQDINXLSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2O/c18-15-7-5-13(6-8-15)10-17(21)20(11-14-3-4-14)12-16-2-1-9-19-16/h5-8,14,16,19H,1-4,9-12H2.
What are the key properties of N-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide?
N-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide has a molecular weight of 290.38 g/mol, XLogP of 2.36, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-(4-fluorophenyl)-N-(pyrrolidin-2-ylmethyl)acetamide is sourced from PubChem (CID 106608292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).