N,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine

C9H20N2 — CID 116950860

IUPACN,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine
SMILESCNC(C(C)C)C1CCCN1
InChIInChI=1S/C9H20N2/c1-7(2)9(10-3)8-5-4-6-11-8/h7-11H,4-6H2,1-3H3
InChIKeyNPJKMGHPWXSJNZ-UHFFFAOYSA-N
MW156.27 g/mol
LogP0.98
Rot. Bonds3

About N,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine

N,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine (PubChem CID 116950860) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is N,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine
PubChem CID116950860
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC NameN,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine
SMILESCNC(C(C)C)C1CCCN1
InChIInChI=1S/C9H20N2/c1-7(2)9(10-3)8-5-4-6-11-8/h7-11H,4-6H2,1-3H3
InChIKeyNPJKMGHPWXSJNZ-UHFFFAOYSA-N
XLogP0.98
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-[(2R,3S)-3-[(2S)-pyrrolidin-2-yl]butan-2-yl]pyrrolidine
CID 129418670
N,N,2-trimethyl-1-pyrrolidin-2-ylpropan-1-amine
CID 116906314
7-(1-pyrrolidin-2-ylethyl)-7-azabicyclo[2.2.1]heptane
CID 131002453
2-(3,4,4-trimethylpentan-2-yl)pyrrolidine
CID 135277685
2-(1-piperidin-2-ylethyl)piperidine
CID 19900914
(2S)-2-propan-2-ylpiperidine
CID 7022854
(2S)-2-[(2S)-butan-2-yl]pyrrolidine
CID 7047855
(2S)-N-methyl-2-[(2S)-piperidin-2-yl]propan-1-amine
CID 124705776
1-cyclobutyl-N-methyl-1-piperidin-2-ylmethanamine
CID 116951232
ethane;2-propan-2-ylpiperidine
CID 154671868
(2R)-2-propan-2-ylazepane
CID 7048221
(1R)-2,2-dimethyl-1-[(2R)-pyrrolidin-2-yl]propan-1-ol
CID 92979517

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine?
The IUPAC name of N,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine (CID 116950860) is N,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine.
What is the SMILES notation for N,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine?
The canonical SMILES for N,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine is CNC(C(C)C)C1CCCN1.
What is the InChIKey of N,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine?
The InChIKey is NPJKMGHPWXSJNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-7(2)9(10-3)8-5-4-6-11-8/h7-11H,4-6H2,1-3H3.
What are the key properties of N,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine?
N,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine has a molecular weight of 156.27 g/mol, XLogP of 0.98, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-1-pyrrolidin-2-ylpropan-1-amine is sourced from PubChem (CID 116950860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).