N-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide

C17H24BrN3O2 — CID 120913805

IUPACN-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide
SMILESO=C(CNC1CCCC1C1COCCN1)Nc1ccc(Br)cc1
InChIInChI=1S/C17H24BrN3O2/c18-12-4-6-13(7-5-12)21-17(22)10-20-15-3-1-2-14(15)16-11-23-9-8-19-16/h4-7,14-16,19-20H,1-3,8-11H2,(H,21,22)
InChIKeySENDGEWXSOAVKV-UHFFFAOYSA-N
MW382.30 g/mol
LogP2.13
Rot. Bonds5

About N-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide

N-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide (PubChem CID 120913805) has the molecular formula C17H24BrN3O2 and a molecular weight of 382.30 g/mol. Its IUPAC name is N-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide
PubChem CID120913805
Molecular FormulaC17H24BrN3O2
Molecular Weight382.30 g/mol
Exact Mass381.11
IUPAC NameN-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide
SMILESO=C(CNC1CCCC1C1COCCN1)Nc1ccc(Br)cc1
InChIInChI=1S/C17H24BrN3O2/c18-12-4-6-13(7-5-12)21-17(22)10-20-15-3-1-2-14(15)16-11-23-9-8-19-16/h4-7,14-16,19-20H,1-3,8-11H2,(H,21,22)
InChIKeySENDGEWXSOAVKV-UHFFFAOYSA-N
XLogP2.13
TPSA62.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.30
LogP ≤ 52.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide?
The IUPAC name of N-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide (CID 120913805) is N-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide.
What is the SMILES notation for N-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide?
The canonical SMILES for N-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide is O=C(CNC1CCCC1C1COCCN1)Nc1ccc(Br)cc1.
What is the InChIKey of N-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide?
The InChIKey is SENDGEWXSOAVKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24BrN3O2/c18-12-4-6-13(7-5-12)21-17(22)10-20-15-3-1-2-14(15)16-11-23-9-8-19-16/h4-7,14-16,19-20H,1-3,8-11H2,(H,21,22).
What are the key properties of N-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide?
N-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide has a molecular weight of 382.30 g/mol, XLogP of 2.13, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide is sourced from PubChem (CID 120913805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).