N'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine

C11H25N3 — CID 62688458

IUPACN'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine
SMILESCN(CCN)CCC1CCCCN1C
InChIInChI=1S/C11H25N3/c1-13(10-7-12)9-6-11-5-3-4-8-14(11)2/h11H,3-10,12H2,1-2H3
InChIKeyVGONFICXSAQBEN-UHFFFAOYSA-N
MW199.34 g/mol
LogP0.75
Rot. Bonds5

About N'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine

N'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine (PubChem CID 62688458) has the molecular formula C11H25N3 and a molecular weight of 199.34 g/mol. Its IUPAC name is N'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine
PubChem CID62688458
Molecular FormulaC11H25N3
Molecular Weight199.34 g/mol
Exact Mass199.20
IUPAC NameN'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine
SMILESCN(CCN)CCC1CCCCN1C
InChIInChI=1S/C11H25N3/c1-13(10-7-12)9-6-11-5-3-4-8-14(11)2/h11H,3-10,12H2,1-2H3
InChIKeyVGONFICXSAQBEN-UHFFFAOYSA-N
XLogP0.75
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 3-[methyl-[2-(1-methylpiperidin-2-yl)ethyl]amino]propanoate
CID 62012811
N-[[2-(aminomethyl)phenyl]methyl]-N-methyl-2-(1-methylpiperidin-2-yl)ethanamine
CID 107911250
2-[(2S)-1-methylazepan-2-yl]ethanamine;molecular hydrogen
CID 178143502
N'-cyclopropyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine
CID 107911214
N,N-dimethyl-3-(1-methylpiperidin-2-yl)propan-1-amine
CID 142889902
2-methyl-2-N-[2-(1-methylpiperidin-2-yl)ethyl]-2-N-propylpropane-1,2-diamine
CID 107911289
N'-ethyl-2,2-dimethyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]propane-1,3-diamine
CID 79667623
2-[methyl-[2-(1-methylpiperidin-2-yl)ethyl]amino]-N-propylacetamide
CID 78823735
N'-hydroxy-2-[methyl-[2-(1-methylpiperidin-2-yl)ethyl]amino]propanimidamide
CID 114015127
N-methyl-2-(1-methylpiperidin-2-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]ethanamine;hydrochloride
CID 120901057
N-[(5-chlorothiophen-2-yl)methyl]-N-methyl-2-(1-methylpiperidin-2-yl)ethanamine
CID 78823684
(2S)-2-amino-N,3-dimethyl-N-[2-(1-methylpiperidin-2-yl)ethyl]butanamide
CID 119894084

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine?
The IUPAC name of N'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine (CID 62688458) is N'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine.
What is the SMILES notation for N'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine?
The canonical SMILES for N'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine is CN(CCN)CCC1CCCCN1C.
What is the InChIKey of N'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine?
The InChIKey is VGONFICXSAQBEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3/c1-13(10-7-12)9-6-11-5-3-4-8-14(11)2/h11H,3-10,12H2,1-2H3.
What are the key properties of N'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine?
N'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine has a molecular weight of 199.34 g/mol, XLogP of 0.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N'-[2-(1-methylpiperidin-2-yl)ethyl]ethane-1,2-diamine is sourced from PubChem (CID 62688458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).