N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine

C13H26N2 — CID 115717125

IUPACN-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine
SMILESCC(NC1CCN(C(C)C)C1)C1CCC1
InChIInChI=1S/C13H26N2/c1-10(2)15-8-7-13(9-15)14-11(3)12-5-4-6-12/h10-14H,4-9H2,1-3H3
InChIKeyBBNGKEZAXQMMQU-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.25
Rot. Bonds4

About N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine

N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine (PubChem CID 115717125) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine
PubChem CID115717125
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine
SMILESCC(NC1CCN(C(C)C)C1)C1CCC1
InChIInChI=1S/C13H26N2/c1-10(2)15-8-7-13(9-15)14-11(3)12-5-4-6-12/h10-14H,4-9H2,1-3H3
InChIKeyBBNGKEZAXQMMQU-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-N,1-di(propan-2-yl)pyrrolidin-3-amine
CID 94057880
(3R)-N-methyl-1-propan-2-ylpyrrolidin-3-amine
CID 55299463
N-[(1S)-1-cycloheptylethyl]-1-methylpyrrolidin-3-amine
CID 81391420
N-(1-cyclohexylethyl)-1-methylpyrrolidin-3-amine
CID 61462202
N-(2-methylcyclopentyl)-1-propan-2-ylpyrrolidin-3-amine
CID 63277763
1-propan-2-yl-N-(trifluoromethyl)pyrrolidin-3-amine
CID 71632965
N-but-3-yn-2-yl-1-propan-2-ylpyrrolidin-3-amine
CID 114415416
N-methyl-1-propan-2-ylpyrrolidin-3-amine;molecular hydrogen
CID 177033452
N-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine
CID 81387724
N-[(1R)-1-cyclopentylethyl]-3-propan-2-yl-3-azabicyclo[3.3.1]nonan-9-amine
CID 81394236
N-(1-methylsulfanylpropan-2-yl)-1-propan-2-ylpyrrolidin-3-amine
CID 115721705
N-[(1S)-1-cyclopentylethyl]-1-methylpiperidin-4-amine
CID 81386748

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine?
The IUPAC name of N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine (CID 115717125) is N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine.
What is the SMILES notation for N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine?
The canonical SMILES for N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine is CC(NC1CCN(C(C)C)C1)C1CCC1.
What is the InChIKey of N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine?
The InChIKey is BBNGKEZAXQMMQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-10(2)15-8-7-13(9-15)14-11(3)12-5-4-6-12/h10-14H,4-9H2,1-3H3.
What are the key properties of N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine?
N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine has a molecular weight of 210.36 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 115717125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).