N-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine

C16H31N3 — CID 105414835

IUPACN-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine
SMILESCN(C)C1(CNC2CCCC2C2CCCN2)CCC1
InChIInChI=1S/C16H31N3/c1-19(2)16(9-5-10-16)12-18-15-7-3-6-13(15)14-8-4-11-17-14/h13-15,17-18H,3-12H2,1-2H3
InChIKeyFZYMRVSFWMHZCI-UHFFFAOYSA-N
MW265.44 g/mol
LogP1.98
Rot. Bonds5

About N-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine

N-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine (PubChem CID 105414835) has the molecular formula C16H31N3 and a molecular weight of 265.44 g/mol. Its IUPAC name is N-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine
PubChem CID105414835
Molecular FormulaC16H31N3
Molecular Weight265.44 g/mol
Exact Mass265.25
IUPAC NameN-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine
SMILESCN(C)C1(CNC2CCCC2C2CCCN2)CCC1
InChIInChI=1S/C16H31N3/c1-19(2)16(9-5-10-16)12-18-15-7-3-6-13(15)14-8-4-11-17-14/h13-15,17-18H,3-12H2,1-2H3
InChIKeyFZYMRVSFWMHZCI-UHFFFAOYSA-N
XLogP1.98
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine?
The IUPAC name of N-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine (CID 105414835) is N-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine.
What is the SMILES notation for N-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine?
The canonical SMILES for N-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine is CN(C)C1(CNC2CCCC2C2CCCN2)CCC1.
What is the InChIKey of N-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine?
The InChIKey is FZYMRVSFWMHZCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3/c1-19(2)16(9-5-10-16)12-18-15-7-3-6-13(15)14-8-4-11-17-14/h13-15,17-18H,3-12H2,1-2H3.
What are the key properties of N-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine?
N-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine has a molecular weight of 265.44 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)cyclobutyl]methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine is sourced from PubChem (CID 105414835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).