1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile

C14H17N3 — CID 139512061

IUPAC1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile
SMILESN#Cc1cccc2c1CC1(CCNCC1)C2N
InChIInChI=1S/C14H17N3/c15-9-10-2-1-3-11-12(10)8-14(13(11)16)4-6-17-7-5-14/h1-3,13,17H,4-8,16H2
InChIKeyMPEVTQBYJMKOJK-UHFFFAOYSA-N
MW227.31 g/mol
LogP1.48
Rot. Bonds

About 1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile

1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile (PubChem CID 139512061) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile.

Molecular Properties

Compound Name1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile
PubChem CID139512061
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile
SMILESN#Cc1cccc2c1CC1(CCNCC1)C2N
InChIInChI=1S/C14H17N3/c15-9-10-2-1-3-11-12(10)8-14(13(11)16)4-6-17-7-5-14/h1-3,13,17H,4-8,16H2
InChIKeyMPEVTQBYJMKOJK-UHFFFAOYSA-N
XLogP1.48
TPSA61.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-4-fluorospiro[1,3-dihydroindene-2,4'-piperidine]-1-amine
CID 139512170
(1S)-4-fluorospiro[1,3-dihydroindene-2,4'-piperidine]-1-amine;hydrochloride
CID 169080151
spiro[1,3-dihydrocyclopenta[a]naphthalene-2,4'-piperidine]-3-amine
CID 155649427
(1S)-spiro[1,3-dihydroindene-2,4'-piperidine]-1-amine
CID 139512047
4-bromospiro[1,3-dihydroindene-2,1'-cyclopropane]-1-amine
CID 82277978
(5S)-spiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine;trihydrochloride
CID 153482804
spiro[5,7-dihydrocyclopenta[b]pyridine-6,4'-piperidine]-5-amine;dihydrochloride
CID 155165273
1-[(1S)-7-cyanospiro[1,3-dihydroindene-2,4'-piperidine]-1-yl]-2-methylpropane-2-sulfinamide
CID 156626427
6-bromospiro[1,3-dihydroindene-2,4'-piperidine]-1-amine
CID 175083255
2-ethynyl-3-piperidin-4-ylbenzonitrile
CID 89444983
(1S)-1-amino-1-deuterio-2,3-dihydroindene-4-carbonitrile;hydrochloride
CID 158658327
(1S)-1-amino-1'-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]spiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile
CID 161452087

Frequently Asked Questions

What is the IUPAC name of 1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile?
The IUPAC name of 1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile (CID 139512061) is 1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile.
What is the SMILES notation for 1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile?
The canonical SMILES for 1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile is N#Cc1cccc2c1CC1(CCNCC1)C2N.
What is the InChIKey of 1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile?
The InChIKey is MPEVTQBYJMKOJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c15-9-10-2-1-3-11-12(10)8-14(13(11)16)4-6-17-7-5-14/h1-3,13,17H,4-8,16H2.
What are the key properties of 1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile?
1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile has a molecular weight of 227.31 g/mol, XLogP of 1.48, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-aminospiro[1,3-dihydroindene-2,4'-piperidine]-4-carbonitrile is sourced from PubChem (CID 139512061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).