N-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine

C14H28N2 — CID 115689744

IUPACN-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine
SMILESCCC1(CNC2CCN(C(C)C)C2)CCC1
InChIInChI=1S/C14H28N2/c1-4-14(7-5-8-14)11-15-13-6-9-16(10-13)12(2)3/h12-13,15H,4-11H2,1-3H3
InChIKeyQLJZKIYXNOWNPV-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.64
Rot. Bonds5

About N-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine

N-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine (PubChem CID 115689744) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine
PubChem CID115689744
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine
SMILESCCC1(CNC2CCN(C(C)C)C2)CCC1
InChIInChI=1S/C14H28N2/c1-4-14(7-5-8-14)11-15-13-6-9-16(10-13)12(2)3/h12-13,15H,4-11H2,1-3H3
InChIKeyQLJZKIYXNOWNPV-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-propan-2-yl-N-[(1-propan-2-ylcyclopropyl)methyl]pyrrolidin-3-amine
CID 115689748
N-[(1-methylsulfanylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine
CID 107266934
N-[(2-methylthiolan-2-yl)methyl]-1-propan-2-ylpyrrolidin-3-amine
CID 80528637
1-benzyl-N-[(1-ethylcyclobutyl)methyl]pyrrolidin-3-amine
CID 103748632
2-[[(3S)-1-propan-2-ylpyrrolidin-3-yl]amino]ethanol
CID 147943395
N-(3-methyl-2-propan-2-ylbutyl)-1-propan-2-ylpyrrolidin-3-amine
CID 102904528
(3S)-N,1-di(propan-2-yl)pyrrolidin-3-amine
CID 94057880
(3R)-N-methyl-1-propan-2-ylpyrrolidin-3-amine
CID 55299463
1-benzyl-N-[(1-ethylcyclobutyl)methyl]piperidin-4-amine
CID 103741195
N-[(1-ethylcyclopentyl)methyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 103847643
4-tert-butyl-N-[(1-ethylcyclobutyl)methyl]cyclohexan-1-amine
CID 114107440
3-methyl-1-[(1-propan-2-ylpyrrolidin-3-yl)amino]butan-2-ol
CID 115689315

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine?
The IUPAC name of N-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine (CID 115689744) is N-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine.
What is the SMILES notation for N-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine?
The canonical SMILES for N-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine is CCC1(CNC2CCN(C(C)C)C2)CCC1.
What is the InChIKey of N-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine?
The InChIKey is QLJZKIYXNOWNPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-4-14(7-5-8-14)11-15-13-6-9-16(10-13)12(2)3/h12-13,15H,4-11H2,1-3H3.
What are the key properties of N-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine?
N-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine has a molecular weight of 224.39 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylcyclobutyl)methyl]-1-propan-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 115689744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).