[6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone

C21H33N5O2 — CID 134700458

IUPAC[6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone
SMILESCN1CCN(C2(CNc3ccc(C(=O)N4CCOCC4)cn3)CCCC2)CC1
InChIInChI=1S/C21H33N5O2/c1-24-8-10-26(11-9-24)21(6-2-3-7-21)17-23-19-5-4-18(16-22-19)20(27)25-12-14-28-15-13-25/h4-5,16H,2-3,6-15,17H2,1H3,(H,22,23)
InChIKeyKNZMPOAMOVGRPQ-UHFFFAOYSA-N
MW387.53 g/mol
LogP1.53
Rot. Bonds5

About [6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone

[6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone (PubChem CID 134700458) has the molecular formula C21H33N5O2 and a molecular weight of 387.53 g/mol. Its IUPAC name is [6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone
PubChem CID134700458
Molecular FormulaC21H33N5O2
Molecular Weight387.53 g/mol
Exact Mass387.26
IUPAC Name[6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone
SMILESCN1CCN(C2(CNc3ccc(C(=O)N4CCOCC4)cn3)CCCC2)CC1
InChIInChI=1S/C21H33N5O2/c1-24-8-10-26(11-9-24)21(6-2-3-7-21)17-23-19-5-4-18(16-22-19)20(27)25-12-14-28-15-13-25/h4-5,16H,2-3,6-15,17H2,1H3,(H,22,23)
InChIKeyKNZMPOAMOVGRPQ-UHFFFAOYSA-N
XLogP1.53
TPSA60.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.53
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone with MolForge

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Related Compounds

morpholin-4-yl-[6-(2-pyrazol-1-ylethylamino)-3-pyridinyl]methanone
CID 134700155
(6-hydrazinyl-3-pyridinyl)-(1,4-oxazepan-4-yl)methanone
CID 62968732
[6-[[2-(dimethylamino)-2-(3-methylthiophen-2-yl)ethyl]amino]-3-pyridinyl]-morpholin-4-ylmethanone
CID 135100948
[6-(2,3-dihydro-1H-inden-5-ylamino)-3-pyridinyl]-morpholin-4-ylmethanone
CID 4582787
[6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]-3-pyridinyl]-morpholin-4-ylmethanone
CID 134707137
[6-(3,5-dichloroanilino)-3-pyridinyl]-morpholin-4-ylmethanone
CID 109153503
(4-methylpiperazin-1-yl)-[6-(4-pyrrolidin-1-ylanilino)-3-pyridinyl]methanone
CID 109154661
[6-[1-(2-methylpyrazol-3-yl)propylamino]-3-pyridinyl]-morpholin-4-ylmethanone
CID 134709508
[6-[(1-hydroxycyclobutyl)methylamino]-3-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 133329812
[6-(propylamino)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 60722911
[6-[2-(1-methylsulfonylpiperidin-2-yl)ethylamino]-3-pyridinyl]-morpholin-4-ylmethanone
CID 135111126
azepan-1-yl-[6-(propylamino)-3-pyridinyl]methanone
CID 62172577

Frequently Asked Questions

What is the IUPAC name of [6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone?
The IUPAC name of [6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone (CID 134700458) is [6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone?
The canonical SMILES for [6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone is CN1CCN(C2(CNc3ccc(C(=O)N4CCOCC4)cn3)CCCC2)CC1.
What is the InChIKey of [6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone?
The InChIKey is KNZMPOAMOVGRPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H33N5O2/c1-24-8-10-26(11-9-24)21(6-2-3-7-21)17-23-19-5-4-18(16-22-19)20(27)25-12-14-28-15-13-25/h4-5,16H,2-3,6-15,17H2,1H3,(H,22,23).
What are the key properties of [6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone?
[6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone has a molecular weight of 387.53 g/mol, XLogP of 1.53, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[[1-(4-methylpiperazin-1-yl)cyclopentyl]methylamino]-3-pyridinyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 134700458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).