N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide

C15H19N3O — CID 104971982

IUPACN-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide
SMILESO=C(NCC[C@H]1CCCN1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C15H19N3O/c19-15(18-9-6-13-2-1-7-16-13)12-3-4-14-11(10-12)5-8-17-14/h3-5,8,10,13,16-17H,1-2,6-7,9H2,(H,18,19)/t13-/m1/s1
InChIKeyPSTIZBYVXRPTHU-CYBMUJFWSA-N
MW257.34 g/mol
LogP2.04
Rot. Bonds4

About N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide

N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide (PubChem CID 104971982) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide
PubChem CID104971982
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide
SMILESO=C(NCC[C@H]1CCCN1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C15H19N3O/c19-15(18-9-6-13-2-1-7-16-13)12-3-4-14-11(10-12)5-8-17-14/h3-5,8,10,13,16-17H,1-2,6-7,9H2,(H,18,19)/t13-/m1/s1
InChIKeyPSTIZBYVXRPTHU-CYBMUJFWSA-N
XLogP2.04
TPSA56.92 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-6-carboxamide
CID 104971741
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]naphthalene-2-carboxamide
CID 104971760
3-bromo-4-methyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793684
4-bromo-3-fluoro-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide
CID 104955112
N-(2-pyrrolidin-2-ylethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 114793811
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1,3-benzodioxole-5-carboxamide
CID 104972064
3-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzene-1,3-dicarboxamide
CID 104955014
4-fluoro-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-3-(trifluoromethyl)benzamide
CID 104955156
N-(piperidin-3-ylmethyl)-1H-indole-5-carboxamide
CID 55230606
4-(difluoromethoxy)-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793978
3-fluoro-4-methoxy-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide
CID 104955125
N-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide
CID 63747724

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide?
The IUPAC name of N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide (CID 104971982) is N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide.
What is the SMILES notation for N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide?
The canonical SMILES for N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide is O=C(NCC[C@H]1CCCN1)c1ccc2[nH]ccc2c1.
What is the InChIKey of N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide?
The InChIKey is PSTIZBYVXRPTHU-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H19N3O/c19-15(18-9-6-13-2-1-7-16-13)12-3-4-14-11(10-12)5-8-17-14/h3-5,8,10,13,16-17H,1-2,6-7,9H2,(H,18,19)/t13-/m1/s1.
What are the key properties of N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide?
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide has a molecular weight of 257.34 g/mol, XLogP of 2.04, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-5-carboxamide is sourced from PubChem (CID 104971982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).