N-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine

C12H25N3 — CID 83107682

IUPACN-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine
SMILESCN(C)C1(CNC2CCNC2)CCCC1
InChIInChI=1S/C12H25N3/c1-15(2)12(6-3-4-7-12)10-14-11-5-8-13-9-11/h11,13-14H,3-10H2,1-2H3
InChIKeyIFHLYAZMSDDMCN-UHFFFAOYSA-N
MW211.35 g/mol
LogP0.81
Rot. Bonds4

About N-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine

N-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine (PubChem CID 83107682) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is N-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine.

Molecular Properties

Compound NameN-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine
PubChem CID83107682
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC NameN-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine
SMILESCN(C)C1(CNC2CCNC2)CCCC1
InChIInChI=1S/C12H25N3/c1-15(2)12(6-3-4-7-12)10-14-11-5-8-13-9-11/h11,13-14H,3-10H2,1-2H3
InChIKeyIFHLYAZMSDDMCN-UHFFFAOYSA-N
XLogP0.81
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine?
The IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine (CID 83107682) is N-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine.
What is the SMILES notation for N-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine?
The canonical SMILES for N-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine is CN(C)C1(CNC2CCNC2)CCCC1.
What is the InChIKey of N-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine?
The InChIKey is IFHLYAZMSDDMCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3/c1-15(2)12(6-3-4-7-12)10-14-11-5-8-13-9-11/h11,13-14H,3-10H2,1-2H3.
What are the key properties of N-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine?
N-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine has a molecular weight of 211.35 g/mol, XLogP of 0.81, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine is sourced from PubChem (CID 83107682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).