N-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine

C11H21N3 — CID 83022403

IUPACN-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine
SMILESCC1CCCC(C)N1NC1=NCCC1
InChIInChI=1S/C11H21N3/c1-9-5-3-6-10(2)14(9)13-11-7-4-8-12-11/h9-10H,3-8H2,1-2H3,(H,12,13)
InChIKeyRNUGEVKPWQVYEU-UHFFFAOYSA-N
MW195.31 g/mol
LogP1.95
Rot. Bonds1

About N-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine

N-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine (PubChem CID 83022403) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine
PubChem CID83022403
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC NameN-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine
SMILESCC1CCCC(C)N1NC1=NCCC1
InChIInChI=1S/C11H21N3/c1-9-5-3-6-10(2)14(9)13-11-7-4-8-12-11/h9-10H,3-8H2,1-2H3,(H,12,13)
InChIKeyRNUGEVKPWQVYEU-UHFFFAOYSA-N
XLogP1.95
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine?
The IUPAC name of N-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine (CID 83022403) is N-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine.
What is the SMILES notation for N-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine?
The canonical SMILES for N-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine is CC1CCCC(C)N1NC1=NCCC1.
What is the InChIKey of N-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine?
The InChIKey is RNUGEVKPWQVYEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-9-5-3-6-10(2)14(9)13-11-7-4-8-12-11/h9-10H,3-8H2,1-2H3,(H,12,13).
What are the key properties of N-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine?
N-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine has a molecular weight of 195.31 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-pyrrol-5-yl)-2,6-dimethylpiperidin-1-amine is sourced from PubChem (CID 83022403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).