[6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone

C20H32N4O3 — CID 56742699

IUPAC[6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone
SMILESCCC(COC)Nc1ccc(C(=O)N2CCC(N3CCOCC3)CC2)cn1
InChIInChI=1S/C20H32N4O3/c1-3-17(15-26-2)22-19-5-4-16(14-21-19)20(25)24-8-6-18(7-9-24)23-10-12-27-13-11-23/h4-5,14,17-18H,3,6-13,15H2,1-2H3,(H,21,22)
InChIKeyUTPFCDGBTHXELI-UHFFFAOYSA-N
MW376.50 g/mol
LogP1.86
Rot. Bonds7

About [6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone

[6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone (PubChem CID 56742699) has the molecular formula C20H32N4O3 and a molecular weight of 376.50 g/mol. Its IUPAC name is [6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone
PubChem CID56742699
Molecular FormulaC20H32N4O3
Molecular Weight376.50 g/mol
Exact Mass376.25
IUPAC Name[6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone
SMILESCCC(COC)Nc1ccc(C(=O)N2CCC(N3CCOCC3)CC2)cn1
InChIInChI=1S/C20H32N4O3/c1-3-17(15-26-2)22-19-5-4-16(14-21-19)20(25)24-8-6-18(7-9-24)23-10-12-27-13-11-23/h4-5,14,17-18H,3,6-13,15H2,1-2H3,(H,21,22)
InChIKeyUTPFCDGBTHXELI-UHFFFAOYSA-N
XLogP1.86
TPSA66.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone with MolForge

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Related Compounds

[6-(cyclopropylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone
CID 56742496
1-[[1-[6-[[(2S)-1-methoxybutan-2-yl]amino]pyridine-3-carbonyl]piperidin-4-yl]methyl]pyrrolidin-2-one
CID 95205069
N-[2-[[5-(4-morpholin-4-ylpiperidine-1-carbonyl)-2-pyridinyl]amino]ethyl]acetamide
CID 56742452
[6-(1-hydroxybutan-2-ylamino)-3-pyridinyl]-[4-(3-methylpiperidin-1-yl)piperidin-1-yl]methanone
CID 123582810
[6-[[(1S,2S)-2-hydroxycyclohexyl]amino]-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone
CID 56744422
[6-[[(3S)-1-methylpiperidin-3-yl]amino]-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone
CID 95226446
(4-morpholin-4-ylpiperidin-1-yl)-[6-[[(3R)-pyrrolidin-3-yl]amino]-3-pyridinyl]methanone
CID 95217183
[4-(6-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]-[2-(1-methoxybutan-2-ylamino)pyrimidin-5-yl]methanone
CID 118191002
[4-(7-fluoro-3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]-[2-(1-methoxybutan-2-ylamino)pyrimidin-5-yl]methanone
CID 118191102
(4-morpholin-4-ylpiperidin-1-yl)-[6-[[(3R)-oxan-3-yl]methylamino]-3-pyridinyl]methanone
CID 95226251
morpholin-4-yl-[6-[[(1R)-1-phenylpropyl]amino]-3-pyridinyl]methanone
CID 135087529
[6-[[2-methoxy-1-(5-methylfuran-2-yl)ethyl]amino]-3-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 133346797

Frequently Asked Questions

What is the IUPAC name of [6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone?
The IUPAC name of [6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone (CID 56742699) is [6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone.
What is the SMILES notation for [6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone?
The canonical SMILES for [6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone is CCC(COC)Nc1ccc(C(=O)N2CCC(N3CCOCC3)CC2)cn1.
What is the InChIKey of [6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone?
The InChIKey is UTPFCDGBTHXELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N4O3/c1-3-17(15-26-2)22-19-5-4-16(14-21-19)20(25)24-8-6-18(7-9-24)23-10-12-27-13-11-23/h4-5,14,17-18H,3,6-13,15H2,1-2H3,(H,21,22).
What are the key properties of [6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone?
[6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone has a molecular weight of 376.50 g/mol, XLogP of 1.86, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(1-methoxybutan-2-ylamino)-3-pyridinyl]-(4-morpholin-4-ylpiperidin-1-yl)methanone is sourced from PubChem (CID 56742699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).