2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol

C16H35N3O — CID 106808834

IUPAC2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol
SMILESCCC(CO)(CCCN(C)CC1CCN(C)CC1)NC
InChIInChI=1S/C16H35N3O/c1-5-16(14-20,17-2)9-6-10-19(4)13-15-7-11-18(3)12-8-15/h15,17,20H,5-14H2,1-4H3
InChIKeyPNYRZAKULYBKAR-UHFFFAOYSA-N
MW285.48 g/mol
LogP1.40
Rot. Bonds9

About 2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol

2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol (PubChem CID 106808834) has the molecular formula C16H35N3O and a molecular weight of 285.48 g/mol. Its IUPAC name is 2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol.

Molecular Properties

Compound Name2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol
PubChem CID106808834
Molecular FormulaC16H35N3O
Molecular Weight285.48 g/mol
Exact Mass285.28
IUPAC Name2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol
SMILESCCC(CO)(CCCN(C)CC1CCN(C)CC1)NC
InChIInChI=1S/C16H35N3O/c1-5-16(14-20,17-2)9-6-10-19(4)13-15-7-11-18(3)12-8-15/h15,17,20H,5-14H2,1-4H3
InChIKeyPNYRZAKULYBKAR-UHFFFAOYSA-N
XLogP1.40
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.48
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol with MolForge

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Related Compounds

2-ethyl-2-(methylamino)-5-[methyl-[(2-methylcyclopropyl)methyl]amino]pentan-1-ol
CID 106808784
5-[cyclopentylmethyl(methyl)amino]-2-ethyl-2-(propylamino)pentan-1-ol
CID 106808716
2-(ethylamino)-2-methyl-5-[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]pentan-1-ol
CID 64788799
2-(cyclopropylamino)-2-methyl-5-[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]pentan-1-ol
CID 64788794
2-ethyl-2-(ethylamino)-5-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol
CID 106809124
N',3,3-trimethyl-N'-[(1-methylpiperidin-4-yl)methyl]hexane-1,6-diamine
CID 65296305
2-ethyl-5-(4-ethylazepan-1-yl)-2-(methylamino)pentan-1-ol
CID 106809648
2-ethyl-2-(ethylamino)-5-[methyl-(1-methylpiperidin-3-yl)amino]pentan-1-ol
CID 106808673
2-amino-2-methyl-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentanamide
CID 63236966
2-ethyl-2-(methylamino)-5-pyrrolidin-1-ylpentan-1-ol
CID 106809047
2-ethyl-5-[methyl-(1-methylpiperidin-3-yl)amino]-2-(propan-2-ylamino)pentan-1-ol
CID 106808674
2-methyl-4-[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]butan-2-ol
CID 79360191

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol?
The IUPAC name of 2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol (CID 106808834) is 2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol.
What is the SMILES notation for 2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol?
The canonical SMILES for 2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol is CCC(CO)(CCCN(C)CC1CCN(C)CC1)NC.
What is the InChIKey of 2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol?
The InChIKey is PNYRZAKULYBKAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35N3O/c1-5-16(14-20,17-2)9-6-10-19(4)13-15-7-11-18(3)12-8-15/h15,17,20H,5-14H2,1-4H3.
What are the key properties of 2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol?
2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol has a molecular weight of 285.48 g/mol, XLogP of 1.40, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-(methylamino)-5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pentan-1-ol is sourced from PubChem (CID 106808834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).