N-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide

C19H20BrN3O — CID 95164536

IUPACN-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide
SMILESO=C(CN(C1CC1)[C@@H]1CCc2ccccc21)Nc1ccc(Br)cn1
InChIInChI=1S/C19H20BrN3O/c20-14-6-10-18(21-11-14)22-19(24)12-23(15-7-8-15)17-9-5-13-3-1-2-4-16(13)17/h1-4,6,10-11,15,17H,5,7-9,12H2,(H,21,22,24)/t17-/m1/s1
InChIKeyOPDOOJGFUFXYGQ-QGZVFWFLSA-N
MW386.29 g/mol
LogP3.93
Rot. Bonds5

About N-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide

N-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide (PubChem CID 95164536) has the molecular formula C19H20BrN3O and a molecular weight of 386.29 g/mol. Its IUPAC name is N-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide.

Molecular Properties

Compound NameN-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide
PubChem CID95164536
Molecular FormulaC19H20BrN3O
Molecular Weight386.29 g/mol
Exact Mass385.08
IUPAC NameN-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide
SMILESO=C(CN(C1CC1)[C@@H]1CCc2ccccc21)Nc1ccc(Br)cn1
InChIInChI=1S/C19H20BrN3O/c20-14-6-10-18(21-11-14)22-19(24)12-23(15-7-8-15)17-9-5-13-3-1-2-4-16(13)17/h1-4,6,10-11,15,17H,5,7-9,12H2,(H,21,22,24)/t17-/m1/s1
InChIKeyOPDOOJGFUFXYGQ-QGZVFWFLSA-N
XLogP3.93
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.29
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclopropyl(1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N-pyridin-4-ylacetamide
CID 154748560
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CID 51097225
5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine
CID 169260360
N-(5-bromo-2-pyridinyl)-2-[cyclopropyl(2-hydroxyethyl)amino]acetamide
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N-[(1S)-1-cyano-1-cyclopropylethyl]-2-[cyclopropyl-[(1S)-2,3-dihydro-1H-inden-1-yl]amino]acetamide
CID 124832179
N-(5-bromo-2-pyridinyl)-2-[cyclobutyl(2-hydroxyethyl)amino]acetamide
CID 102676743
N-(5-bromo-2-pyridinyl)-2-[(1,1-dioxothiolan-3-yl)-methylamino]acetamide
CID 47131087
N-(5-bromo-2-pyridinyl)-2-[[2-(2-chloroanilino)-2-oxoethyl]-methylamino]acetamide
CID 38171990
3-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]-N-(2,6-dichlorophenyl)propanamide
CID 56525625
N-(5-bromo-2-pyridinyl)-2-(2,3-dihydroindol-1-yl)acetamide
CID 17376673
2-[2,3-dihydro-1H-inden-1-yl-(1,1-dioxothiolan-3-yl)amino]acetic acid
CID 65059735
2-[cyclopropyl-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 52511480

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide?
The IUPAC name of N-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide (CID 95164536) is N-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide.
What is the SMILES notation for N-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide?
The canonical SMILES for N-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide is O=C(CN(C1CC1)[C@@H]1CCc2ccccc21)Nc1ccc(Br)cn1.
What is the InChIKey of N-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide?
The InChIKey is OPDOOJGFUFXYGQ-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H20BrN3O/c20-14-6-10-18(21-11-14)22-19(24)12-23(15-7-8-15)17-9-5-13-3-1-2-4-16(13)17/h1-4,6,10-11,15,17H,5,7-9,12H2,(H,21,22,24)/t17-/m1/s1.
What are the key properties of N-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide?
N-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide has a molecular weight of 386.29 g/mol, XLogP of 3.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-pyridinyl)-2-[cyclopropyl-[(1R)-2,3-dihydro-1H-inden-1-yl]amino]acetamide is sourced from PubChem (CID 95164536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).