1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine

C19H45N3O — CID 142483010

IUPAC1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine
SMILESCC.CC.CC.CN1CCN(C2CC2)CC1.CN1CCOCC1
InChIInChI=1S/C8H16N2.C5H11NO.3C2H6/c1-9-4-6-10(7-5-9)8-2-3-8;1-6-2-4-7-5-3-6;3*1-2/h8H,2-7H2,1H3;2-5H2,1H3;3*1-2H3
InChIKeyNTUSELNUJMVAFS-UHFFFAOYSA-N
MW331.59 g/mol
LogP3.42
Rot. Bonds1

About 1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine

1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine (PubChem CID 142483010) has the molecular formula C19H45N3O and a molecular weight of 331.59 g/mol. Its IUPAC name is 1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine.

Molecular Properties

Compound Name1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine
PubChem CID142483010
Molecular FormulaC19H45N3O
Molecular Weight331.59 g/mol
Exact Mass331.36
IUPAC Name1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine
SMILESCC.CC.CC.CN1CCN(C2CC2)CC1.CN1CCOCC1
InChIInChI=1S/C8H16N2.C5H11NO.3C2H6/c1-9-4-6-10(7-5-9)8-2-3-8;1-6-2-4-7-5-3-6;3*1-2/h8H,2-7H2,1H3;2-5H2,1H3;3*1-2H3
InChIKeyNTUSELNUJMVAFS-UHFFFAOYSA-N
XLogP3.42
TPSA18.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.59
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-cyclopropylmorpholine;ethane
CID 155594914
ethane;1-methyl-4-(1-methylpiperidin-4-yl)piperazine
CID 144911273
ethane;4-methylmorpholine
CID 54432133
4-[1-(4-methylpiperazin-1-yl)sulfonylpiperidin-4-yl]morpholine
CID 166272653
ethane;1-methyl-4-(oxetan-3-yl)piperazine
CID 144595664
1-(4-iodocyclohexyl)-4-methylpiperazine
CID 134444835
19-methyl-1,4,7,10,13,16-hexaoxa-19-azacyclohenicosane
CID 6612303
4-fluoro-1-methylpiperidine;4-methylmorpholine
CID 153371912
lithium;4-methylmorpholine;chloride
CID 172748649
1-methyl-4-(oxolan-3-yl)-1,4-diazepane
CID 143294368
(9aS)-8-methyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[2,1-c][1,4]oxazine;(9aR)-8-methyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[2,1-c][1,4]oxazine;8-methyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[2,1-c][1,4]oxazine
CID 161070530
4,13-dimethyl-7,10,19,24-tetraoxa-1,4,13,16-tetrazabicyclo[14.5.5]hexacosane
CID 174301861

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine?
The IUPAC name of 1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine (CID 142483010) is 1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine.
What is the SMILES notation for 1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine?
The canonical SMILES for 1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine is CC.CC.CC.CN1CCN(C2CC2)CC1.CN1CCOCC1.
What is the InChIKey of 1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine?
The InChIKey is NTUSELNUJMVAFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2.C5H11NO.3C2H6/c1-9-4-6-10(7-5-9)8-2-3-8;1-6-2-4-7-5-3-6;3*1-2/h8H,2-7H2,1H3;2-5H2,1H3;3*1-2H3.
What are the key properties of 1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine?
1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine has a molecular weight of 331.59 g/mol, XLogP of 3.42, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-4-methylpiperazine;ethane;4-methylmorpholine is sourced from PubChem (CID 142483010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).