N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide

C16H22N2O — CID 106893460

IUPACN-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide
SMILESO=C(NCC[C@@H]1CCCN1)C1Cc2ccccc2C1
InChIInChI=1S/C16H22N2O/c19-16(18-9-7-15-6-3-8-17-15)14-10-12-4-1-2-5-13(12)11-14/h1-2,4-5,14-15,17H,3,6-11H2,(H,18,19)/t15-/m0/s1
InChIKeyZRSLKIVLFZODPH-HNNXBMFYSA-N
MW258.36 g/mol
LogP1.66
Rot. Bonds4

About N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide

N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide (PubChem CID 106893460) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide.

Molecular Properties

Compound NameN-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide
PubChem CID106893460
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC NameN-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide
SMILESO=C(NCC[C@@H]1CCCN1)C1Cc2ccccc2C1
InChIInChI=1S/C16H22N2O/c19-16(18-9-7-15-6-3-8-17-15)14-10-12-4-1-2-5-13(12)11-14/h1-2,4-5,14-15,17H,3,6-11H2,(H,18,19)/t15-/m0/s1
InChIKeyZRSLKIVLFZODPH-HNNXBMFYSA-N
XLogP1.66
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[(2S)-piperidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide
CID 124681379
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]cyclopentanecarboxamide
CID 104972065
N-(2-pyrrolidin-2-ylethyl)cyclopent-3-ene-1-carboxamide
CID 114793726
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-1a,2,3,7b-tetrahydro-1H-cyclopropa[a]naphthalene-1-carboxamide
CID 104972141
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]naphthalene-2-carboxamide
CID 104971760
2-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]benzamide
CID 104972061
3-phenyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]prop-2-ynamide
CID 104972166
2,6-difluoro-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793746
2-phenoxy-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]acetamide
CID 104971951
2-ethyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793888
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-2-carboxamide
CID 104955318
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1-benzofuran-2-carboxamide
CID 104972010

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide?
The IUPAC name of N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide (CID 106893460) is N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide.
What is the SMILES notation for N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide?
The canonical SMILES for N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide is O=C(NCC[C@@H]1CCCN1)C1Cc2ccccc2C1.
What is the InChIKey of N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide?
The InChIKey is ZRSLKIVLFZODPH-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H22N2O/c19-16(18-9-7-15-6-3-8-17-15)14-10-12-4-1-2-5-13(12)11-14/h1-2,4-5,14-15,17H,3,6-11H2,(H,18,19)/t15-/m0/s1.
What are the key properties of N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide?
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide has a molecular weight of 258.36 g/mol, XLogP of 1.66, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-2-carboxamide is sourced from PubChem (CID 106893460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).