N-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine

C17H34N2 — CID 83221375

IUPACN-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine
SMILESCCC1CCC(C)N1CC(CC)(CC)CNC1CC1
InChIInChI=1S/C17H34N2/c1-5-16-11-8-14(4)19(16)13-17(6-2,7-3)12-18-15-9-10-15/h14-16,18H,5-13H2,1-4H3
InChIKeyDBWWKJSTEPLMGP-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.81
Rot. Bonds8

About N-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine

N-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine (PubChem CID 83221375) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is N-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine
PubChem CID83221375
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC NameN-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine
SMILESCCC1CCC(C)N1CC(CC)(CC)CNC1CC1
InChIInChI=1S/C17H34N2/c1-5-16-11-8-14(4)19(16)13-17(6-2,7-3)12-18-15-9-10-15/h14-16,18H,5-13H2,1-4H3
InChIKeyDBWWKJSTEPLMGP-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[6-(2-ethyl-5-methylpyrrolidin-1-yl)hexyl]cyclopropanamine
CID 83221067
N-[2-ethyl-2-[(4-propylpiperazin-1-yl)methyl]butyl]cyclopropanamine
CID 62261471
N'-cyclopropyl-2,2-diethylpropane-1,3-diamine
CID 115432791
1-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methylpropan-2-ol
CID 83224284
N-[2-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)butyl]cyclopropanamine
CID 66371193
N-[2-ethyl-2-[(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methyl]butyl]cyclopropanamine
CID 79933628
N-[[1-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]cyclohexyl]methyl]cyclopropanamine
CID 83220975
1-(2,6-dimethylpiperidin-1-yl)-2-(2-ethyl-5-methylpyrrolidin-1-yl)ethanone
CID 75399387
N-[[4-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 83221379
2-[4-[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-1,4-diazepan-1-yl]ethanol
CID 107226446
N-[[4-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]methyl]cyclopropanamine
CID 83221719
N-[[3-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine
CID 83221374

Frequently Asked Questions

What is the IUPAC name of N-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine?
The IUPAC name of N-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine (CID 83221375) is N-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine.
What is the SMILES notation for N-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine?
The canonical SMILES for N-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine is CCC1CCC(C)N1CC(CC)(CC)CNC1CC1.
What is the InChIKey of N-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine?
The InChIKey is DBWWKJSTEPLMGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-5-16-11-8-14(4)19(16)13-17(6-2,7-3)12-18-15-9-10-15/h14-16,18H,5-13H2,1-4H3.
What are the key properties of N-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine?
N-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine has a molecular weight of 266.47 g/mol, XLogP of 3.81, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-ethyl-2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]butyl]cyclopropanamine is sourced from PubChem (CID 83221375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).