[6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone

C19H26N4O2S — CID 135100948

IUPAC[6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone
SMILESCc1ccsc1C(CNc1ccc(C(=O)N2CCOCC2)cn1)N(C)C
InChIInChI=1S/C19H26N4O2S/c1-14-6-11-26-18(14)16(22(2)3)13-21-17-5-4-15(12-20-17)19(24)23-7-9-25-10-8-23/h4-6,11-12,16H,7-10,13H2,1-3H3,(H,20,21)
InChIKeyVZZJFIIGGKMREE-UHFFFAOYSA-N
MW374.51 g/mol
LogP2.64
Rot. Bonds6

About [6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone

[6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone (PubChem CID 135100948) has the molecular formula C19H26N4O2S and a molecular weight of 374.51 g/mol. Its IUPAC name is [6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone
PubChem CID135100948
Molecular FormulaC19H26N4O2S
Molecular Weight374.51 g/mol
Exact Mass374.18
IUPAC Name[6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone
SMILESCc1ccsc1C(CNc1ccc(C(=O)N2CCOCC2)cn1)N(C)C
InChIInChI=1S/C19H26N4O2S/c1-14-6-11-26-18(14)16(22(2)3)13-21-17-5-4-15(12-20-17)19(24)23-7-9-25-10-8-23/h4-6,11-12,16H,7-10,13H2,1-3H3,(H,20,21)
InChIKeyVZZJFIIGGKMREE-UHFFFAOYSA-N
XLogP2.64
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone with MolForge

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Related Compounds

[6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone
CID 134700458
morpholin-4-yl-[6-[[(1R)-1-phenylpropyl]amino]-3-pyridinyl]methanone
CID 135087529
[6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone
CID 134707137
morpholin-4-yl-[6-(2-pyrazol-1-ylethylamino)-3-pyridinyl]methanone
CID 134700155
[6-[1-(2-methylpyrazol-3-yl)propylamino]-3-pyridinyl]-morpholin-4-ylmethanone
CID 134709508
(6-hydrazinyl-3-pyridinyl)-(1,4-oxazepan-4-yl)methanone
CID 62968732
[6-(3,5-dichloroanilino)-3-pyridinyl]-morpholin-4-ylmethanone
CID 109153503
morpholin-4-yl-[6-(2-morpholin-4-ylanilino)-3-pyridinyl]methanone
CID 109153485
[4-(furan-2-carbonyl)piperazin-1-yl]-[6-(2-methylpropylamino)-3-pyridinyl]methanone
CID 109151822
6-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide
CID 115579964
[6-[2-(1-methylsulfonylpiperidin-2-yl)ethylamino]-3-pyridinyl]-morpholin-4-ylmethanone
CID 135111126
N-[2-[[5-(4-morpholin-4-ylpiperidine-1-carbonyl)-2-pyridinyl]amino]ethyl]acetamide
CID 56742452

Frequently Asked Questions

What is the IUPAC name of [6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone?
The IUPAC name of [6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone (CID 135100948) is [6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone?
The canonical SMILES for [6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone is Cc1ccsc1C(CNc1ccc(C(=O)N2CCOCC2)cn1)N(C)C.
What is the InChIKey of [6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone?
The InChIKey is VZZJFIIGGKMREE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2S/c1-14-6-11-26-18(14)16(22(2)3)13-21-17-5-4-15(12-20-17)19(24)23-7-9-25-10-8-23/h4-6,11-12,16H,7-10,13H2,1-3H3,(H,20,21).
What are the key properties of [6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone?
[6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone has a molecular weight of 374.51 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 135100948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).