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

C15H25N3 — CID 104736500

IUPAC3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine
SMILESCCC(C)(C(N)Cc1cccnc1)N1CCCC1
InChIInChI=1S/C15H25N3/c1-3-15(2,18-9-4-5-10-18)14(16)11-13-7-6-8-17-12-13/h6-8,12,14H,3-5,9-11,16H2,1-2H3
InChIKeyIKIVWCRXCBADHE-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.22
Rot. Bonds5

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

3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine (PubChem CID 104736500) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine.

Molecular Properties

Compound Name3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine
PubChem CID104736500
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine
SMILESCCC(C)(C(N)Cc1cccnc1)N1CCCC1
InChIInChI=1S/C15H25N3/c1-3-15(2,18-9-4-5-10-18)14(16)11-13-7-6-8-17-12-13/h6-8,12,14H,3-5,9-11,16H2,1-2H3
InChIKeyIKIVWCRXCBADHE-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

N-ethyl-3-methyl-3-piperidin-1-yl-1-pyridin-3-ylpentan-2-amine
CID 104736506
3-ethyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-ol
CID 104736143
N-ethyl-3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylbutan-2-amine
CID 104736482
3-methyl-1-pyridin-2-yl-3-pyrrolidin-1-ylpentan-2-amine
CID 79068478
1-(1-ethylpyrazol-4-yl)-3-methyl-3-pyrrolidin-1-ylpentan-2-amine
CID 79069573
3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine
CID 116759597
3-methyl-N-propyl-1-pyridin-3-yl-3-pyrrolidin-1-ylbutan-2-amine
CID 104736483
3-methyl-3-morpholin-4-yl-1-phenylpentan-2-amine
CID 79065628
3-methyl-3-pyrrolidin-1-yl-1-thiophen-2-ylpentan-2-amine
CID 79068401
3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-one
CID 104735994
1-(3-fluoro-4-pyridinyl)-2-methyl-2-pyrrolidin-1-ylbutan-1-amine
CID 113447268
1-(3-fluoro-4-pyridinyl)-2-methyl-2-piperidin-1-ylbutan-1-amine
CID 104738438

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine?
The IUPAC name of 3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine (CID 104736500) is 3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine.
What is the SMILES notation for 3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine?
The canonical SMILES for 3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine is CCC(C)(C(N)Cc1cccnc1)N1CCCC1.
What is the InChIKey of 3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine?
The InChIKey is IKIVWCRXCBADHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-3-15(2,18-9-4-5-10-18)14(16)11-13-7-6-8-17-12-13/h6-8,12,14H,3-5,9-11,16H2,1-2H3.
What are the key properties of 3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine?
3-methyl-1-pyridin-3-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-3-yl-3-pyrrolidin-1-ylpentan-2-amine is sourced from PubChem (CID 104736500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).