2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine

C16H32N2O — CID 103273660

IUPAC2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine
SMILESCC(C)CNCCC1(OCCN2CCCC2)CCC1
InChIInChI=1S/C16H32N2O/c1-15(2)14-17-9-8-16(6-5-7-16)19-13-12-18-10-3-4-11-18/h15,17H,3-14H2,1-2H3
InChIKeyNXXQOSHTMJEQPD-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.66
Rot. Bonds9

About 2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine

2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine (PubChem CID 103273660) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine
PubChem CID103273660
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine
SMILESCC(C)CNCCC1(OCCN2CCCC2)CCC1
InChIInChI=1S/C16H32N2O/c1-15(2)14-17-9-8-16(6-5-7-16)19-13-12-18-10-3-4-11-18/h15,17H,3-14H2,1-2H3
InChIKeyNXXQOSHTMJEQPD-UHFFFAOYSA-N
XLogP2.66
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-methyl-N-[2-[1-(4-methylpentoxy)cyclobutyl]ethyl]propan-1-amine
CID 103273231
2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-2-amine
CID 103273661
2-methyl-N-[2-[1-[2-(1-methylpyrrolidin-2-yl)ethoxy]cyclobutyl]ethyl]propan-1-amine
CID 103273693
N-[2-(azocan-1-yl)ethyl]-2-methylpropan-1-amine
CID 62419801
2-methyl-N-[3-[2-(2-pyrrolidin-1-ylethoxy)ethoxy]propyl]propan-1-amine
CID 57222400
N-(2-methylpropyl)-4-(2-pyrrolidin-1-ylethoxy)pentan-1-amine
CID 55077371
2-methyl-N-[2-(2-pyrrolidin-1-ylethoxy)propyl]propan-1-amine
CID 62460018
N-[2-[1-(cyclopentylmethoxy)cyclobutyl]ethyl]-2-methylpropan-1-amine
CID 103274232
N-(2-methylpropyl)-4-piperidin-1-ylbutan-1-amine
CID 62425413
5-(azepan-1-yl)-N-(2-methylpropyl)pentan-1-amine
CID 62438364
N-[2-(1-cyclohexyloxycyclobutyl)ethyl]-2-methylpropan-1-amine
CID 103273010
N-[2-[1-(2-ethylhexoxy)cyclobutyl]ethyl]-2-methylpropan-1-amine
CID 103273223

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine (CID 103273660) is 2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine is CC(C)CNCCC1(OCCN2CCCC2)CCC1.
What is the InChIKey of 2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine?
The InChIKey is NXXQOSHTMJEQPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-15(2)14-17-9-8-16(6-5-7-16)19-13-12-18-10-3-4-11-18/h15,17H,3-14H2,1-2H3.
What are the key properties of 2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine?
2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine has a molecular weight of 268.44 g/mol, XLogP of 2.66, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[1-(2-pyrrolidin-1-ylethoxy)cyclobutyl]ethyl]propan-1-amine is sourced from PubChem (CID 103273660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).