2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide

C19H28N4O2 — CID 56815711

IUPAC2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide
SMILESNC(=O)CN(CC(=O)NCCN1CCc2ccccc21)C1CCCC1
InChIInChI=1S/C19H28N4O2/c20-18(24)13-23(16-6-2-3-7-16)14-19(25)21-10-12-22-11-9-15-5-1-4-8-17(15)22/h1,4-5,8,16H,2-3,6-7,9-14H2,(H2,20,24)(H,21,25)
InChIKeyMPDRYVCAQYJJLU-UHFFFAOYSA-N
MW344.46 g/mol
LogP0.90
Rot. Bonds8

About 2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide

2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide (PubChem CID 56815711) has the molecular formula C19H28N4O2 and a molecular weight of 344.46 g/mol. Its IUPAC name is 2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide.

Molecular Properties

Compound Name2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide
PubChem CID56815711
Molecular FormulaC19H28N4O2
Molecular Weight344.46 g/mol
Exact Mass344.22
IUPAC Name2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide
SMILESNC(=O)CN(CC(=O)NCCN1CCc2ccccc21)C1CCCC1
InChIInChI=1S/C19H28N4O2/c20-18(24)13-23(16-6-2-3-7-16)14-19(25)21-10-12-22-11-9-15-5-1-4-8-17(15)22/h1,4-5,8,16H,2-3,6-7,9-14H2,(H2,20,24)(H,21,25)
InChIKeyMPDRYVCAQYJJLU-UHFFFAOYSA-N
XLogP0.90
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[cyclopentyl-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]amino]acetamide
CID 56815709
3-[3-(2,3-dihydroindol-1-yl)propylamino]-3-oxopropanoic acid
CID 62230278
3-(2,3,3a,4,5,6,7,7a-octahydro-1H-indazol-3-yl)-N-[2-(2,3-dihydroindol-1-yl)ethyl]propanamide
CID 133108274
N-[2-(2,3-dihydroindol-1-yl)ethyl]cyclopentanamine
CID 55024431
N-[2-(2,3-dihydroindol-1-yl)ethyl]piperidine-4-carboxamide
CID 155615979
3-amino-N-[3-(2,3-dihydroindol-1-yl)propyl]propanamide;dihydrochloride
CID 119851222
cis-(1S,3R)-3-[2-(2,3-dihydroindol-1-yl)ethylcarbamoyl]cyclopentane-1-carboxylic acid
CID 133134060
N-[2-(2,3-dihydroindol-1-yl)ethyl]-5-phenylpentanamide
CID 110301318
N-[2-(2,3-dihydroindol-1-yl)ethyl]-N-methylcyclohexanamine
CID 54806175
N-[2-(2,3-dihydroindol-1-yl)ethyl]-4-(1,3-dioxoisoindol-2-yl)butanamide
CID 112502054
3-amino-N-[3-(2,3-dihydroindol-1-yl)propyl]cyclohexane-1-carboxamide
CID 119851186
N-[2-(2,3-dihydroindol-1-yl)ethyl]-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carboxamide
CID 112502055

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide?
The IUPAC name of 2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide (CID 56815711) is 2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide.
What is the SMILES notation for 2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide?
The canonical SMILES for 2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide is NC(=O)CN(CC(=O)NCCN1CCc2ccccc21)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide?
The InChIKey is MPDRYVCAQYJJLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O2/c20-18(24)13-23(16-6-2-3-7-16)14-19(25)21-10-12-22-11-9-15-5-1-4-8-17(15)22/h1,4-5,8,16H,2-3,6-7,9-14H2,(H2,20,24)(H,21,25).
What are the key properties of 2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide?
2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide has a molecular weight of 344.46 g/mol, XLogP of 0.90, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-[2-[2-(2,3-dihydroindol-1-yl)ethylamino]-2-oxoethyl]amino]acetamide is sourced from PubChem (CID 56815711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).