N-pyrrolidin-3-yl-1H-indole-5-carboxamide

C13H15N3O — CID 63747913

IUPACN-pyrrolidin-3-yl-1H-indole-5-carboxamide
SMILESO=C(NC1CCNC1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C13H15N3O/c17-13(16-11-4-5-14-8-11)10-1-2-12-9(7-10)3-6-15-12/h1-3,6-7,11,14-15H,4-5,8H2,(H,16,17)
InChIKeyZRPGGSFYPYDUJU-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.26
Rot. Bonds2

About N-pyrrolidin-3-yl-1H-indole-5-carboxamide

N-pyrrolidin-3-yl-1H-indole-5-carboxamide (PubChem CID 63747913) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is N-pyrrolidin-3-yl-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-pyrrolidin-3-yl-1H-indole-5-carboxamide
PubChem CID63747913
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC NameN-pyrrolidin-3-yl-1H-indole-5-carboxamide
SMILESO=C(NC1CCNC1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C13H15N3O/c17-13(16-11-4-5-14-8-11)10-1-2-12-9(7-10)3-6-15-12/h1-3,6-7,11,14-15H,4-5,8H2,(H,16,17)
InChIKeyZRPGGSFYPYDUJU-UHFFFAOYSA-N
XLogP1.26
TPSA56.92 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-(azetidin-3-yl)-1H-indole-6-carboxamide
CID 66186513
N-(2,3-dihydro-1H-inden-2-yl)-1H-indole-5-carboxamide
CID 91395500
2-[4-(1H-indole-5-carbonylamino)piperidin-1-yl]acetic acid
CID 121494840
3,4-dihydroxy-N-[(3S)-pyrrolidin-3-yl]benzamide
CID 107728777
N-(piperidin-4-ylmethyl)-1H-indole-5-carboxamide
CID 63747736
N-(piperidin-3-ylmethyl)-1H-indole-5-carboxamide
CID 55230606
4-hydroxy-N-[(3S)-pyrrolidin-3-yl]benzamide
CID 79689032
N-cyclohexyl-1H-indole-6-carboxamide
CID 39706974
N-[(1S,3S,4R)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]-1H-indole-5-carboxamide
CID 98783804
N-[1-[(1S)-1-pyridin-4-ylethyl]piperidin-4-yl]-1H-indole-5-carboxamide
CID 124591554
3-bromo-4-methyl-N-pyrrolidin-3-ylbenzamide
CID 81472649
3-iodo-4-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119454037

Frequently Asked Questions

What is the IUPAC name of N-pyrrolidin-3-yl-1H-indole-5-carboxamide?
The IUPAC name of N-pyrrolidin-3-yl-1H-indole-5-carboxamide (CID 63747913) is N-pyrrolidin-3-yl-1H-indole-5-carboxamide.
What is the SMILES notation for N-pyrrolidin-3-yl-1H-indole-5-carboxamide?
The canonical SMILES for N-pyrrolidin-3-yl-1H-indole-5-carboxamide is O=C(NC1CCNC1)c1ccc2[nH]ccc2c1.
What is the InChIKey of N-pyrrolidin-3-yl-1H-indole-5-carboxamide?
The InChIKey is ZRPGGSFYPYDUJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c17-13(16-11-4-5-14-8-11)10-1-2-12-9(7-10)3-6-15-12/h1-3,6-7,11,14-15H,4-5,8H2,(H,16,17).
What are the key properties of N-pyrrolidin-3-yl-1H-indole-5-carboxamide?
N-pyrrolidin-3-yl-1H-indole-5-carboxamide has a molecular weight of 229.28 g/mol, XLogP of 1.26, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrrolidin-3-yl-1H-indole-5-carboxamide is sourced from PubChem (CID 63747913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).