3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine

C15H25N3 — CID 79068478

IUPAC3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine
SMILESCCC(C)(C(N)Cc1ccccn1)N1CCCC1
InChIInChI=1S/C15H25N3/c1-3-15(2,18-10-6-7-11-18)14(16)12-13-8-4-5-9-17-13/h4-5,8-9,14H,3,6-7,10-12,16H2,1-2H3
InChIKeyDSIIFHLCSLYOOH-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.22
Rot. Bonds5

About 3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine

3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine (PubChem CID 79068478) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine.

Molecular Properties

Compound Name3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine
PubChem CID79068478
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine
SMILESCCC(C)(C(N)Cc1ccccn1)N1CCCC1
InChIInChI=1S/C15H25N3/c1-3-15(2,18-10-6-7-11-18)14(16)12-13-8-4-5-9-17-13/h4-5,8-9,14H,3,6-7,10-12,16H2,1-2H3
InChIKeyDSIIFHLCSLYOOH-UHFFFAOYSA-N
XLogP2.22
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine
CID 104736500
3-methyl-3-pyrrolidin-1-yl-1-thiophen-2-ylpentan-2-amine
CID 79068401
(3R)-3-amino-2,2-dimethyl-4-pyridin-2-ylbutan-1-ol
CID 135132625
3-methyl-3-piperidin-1-yl-1-(1-propylimidazol-2-yl)pentan-2-amine
CID 79751932
3-(2-amino-3-methyl-3-morpholin-4-ylpentyl)pyridin-2-amine
CID 79065403
1-(3-chloro-2-fluorophenyl)-3-methyl-3-piperidin-1-ylpentan-2-amine
CID 102857722
2-(2-pyrrolidin-1-ylpropyl)pyridine
CID 90965469
3-methyl-3-morpholin-4-yl-1-phenylpentan-2-amine
CID 79065628
3-methyl-3-piperidin-1-yl-1-(2-propyl-1,2,4-triazol-3-yl)pentan-2-amine
CID 79060447
1-(1-ethylpyrazol-4-yl)-3-methyl-3-pyrrolidin-1-ylpentan-2-amine
CID 79069573
2-methyl-1-(2-methylphenyl)-2-pyrrolidin-1-ylbutan-1-amine
CID 79069491
1-(2-ethyl-5-methylpyrazol-3-yl)-3-methyl-3-pyrrolidin-1-ylpentan-2-amine
CID 79068561

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine?
The IUPAC name of 3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine (CID 79068478) is 3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine.
What is the SMILES notation for 3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine?
The canonical SMILES for 3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine is CCC(C)(C(N)Cc1ccccn1)N1CCCC1.
What is the InChIKey of 3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine?
The InChIKey is DSIIFHLCSLYOOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-3-15(2,18-10-6-7-11-18)14(16)12-13-8-4-5-9-17-13/h4-5,8-9,14H,3,6-7,10-12,16H2,1-2H3.
What are the key properties of 3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine?
3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine has a molecular weight of 247.39 g/mol, XLogP of 2.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine is sourced from PubChem (CID 79068478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).