[6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone

C19H21N3O2 — CID 4582787

IUPAC[6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(Nc2ccc3c(c2)CCC3)nc1)N1CCOCC1
InChIInChI=1S/C19H21N3O2/c23-19(22-8-10-24-11-9-22)16-5-7-18(20-13-16)21-17-6-4-14-2-1-3-15(14)12-17/h4-7,12-13H,1-3,8-11H2,(H,20,21)
InChIKeyGCMZILAZKBYZAB-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.79
Rot. Bonds3

About [6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone

[6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone (PubChem CID 4582787) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is [6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone
PubChem CID4582787
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name[6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(Nc2ccc3c(c2)CCC3)nc1)N1CCOCC1
InChIInChI=1S/C19H21N3O2/c23-19(22-8-10-24-11-9-22)16-5-7-18(20-13-16)21-17-6-4-14-2-1-3-15(14)12-17/h4-7,12-13H,1-3,8-11H2,(H,20,21)
InChIKeyGCMZILAZKBYZAB-UHFFFAOYSA-N
XLogP2.79
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[6-(3,5-dichloroanilino)-3-pyridinyl]-morpholin-4-ylmethanone
CID 109153503
[6-[4-chloro-3-(trifluoromethyl)anilino]-3-pyridinyl]-morpholin-4-ylmethanone
CID 109153498
(6-hydrazinyl-3-pyridinyl)-(1,4-oxazepan-4-yl)methanone
CID 62968732
piperidin-1-yl-[6-(4-pyrrolidin-1-ylanilino)-3-pyridinyl]methanone
CID 109152366
[6-(4-chloroanilino)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 1441202
morpholin-4-yl-[6-(2-morpholin-4-ylanilino)-3-pyridinyl]methanone
CID 109153485
(4-methylpiperazin-1-yl)-[6-(4-pyrrolidin-1-ylanilino)-3-pyridinyl]methanone
CID 109154661
1-[4-[6-(3,4-dichloroanilino)pyridine-3-carbonyl]piperazin-1-yl]ethanone
CID 109155276
[6-[[4-amino-5-(trifluoromethyl)-2-pyridinyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone
CID 141220618
[5-chloro-6-(2,3-dihydro-1H-inden-5-ylmethylamino)-3-pyridinyl]-morpholin-4-ylmethanone
CID 133273306
[6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone
CID 134700458
methyl 4-chloro-3-[[5-(morpholine-4-carbonyl)-2-pyridinyl]amino]benzoate
CID 109153479

Frequently Asked Questions

What is the IUPAC name of [6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone?
The IUPAC name of [6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone (CID 4582787) is [6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone?
The canonical SMILES for [6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone is O=C(c1ccc(Nc2ccc3c(c2)CCC3)nc1)N1CCOCC1.
What is the InChIKey of [6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone?
The InChIKey is GCMZILAZKBYZAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c23-19(22-8-10-24-11-9-22)16-5-7-18(20-13-16)21-17-6-4-14-2-1-3-15(14)12-17/h4-7,12-13H,1-3,8-11H2,(H,20,21).
What are the key properties of [6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone?
[6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone has a molecular weight of 323.40 g/mol, XLogP of 2.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 4582787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).