1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol

C15H25N3O — CID 79069633

IUPAC1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol
SMILESCCC(C)(C(O)Cc1cnccc1N)N1CCCC1
InChIInChI=1S/C15H25N3O/c1-3-15(2,18-8-4-5-9-18)14(19)10-12-11-17-7-6-13(12)16/h6-7,11,14,19H,3-5,8-10H2,1-2H3,(H2,16,17)
InChIKeyMEWVHGIEBDHGMO-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.83
Rot. Bonds5

About 1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol

1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol (PubChem CID 79069633) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol.

Molecular Properties

Compound Name1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol
PubChem CID79069633
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol
SMILESCCC(C)(C(O)Cc1cnccc1N)N1CCCC1
InChIInChI=1S/C15H25N3O/c1-3-15(2,18-8-4-5-9-18)14(19)10-12-11-17-7-6-13(12)16/h6-7,11,14,19H,3-5,8-10H2,1-2H3,(H2,16,17)
InChIKeyMEWVHGIEBDHGMO-UHFFFAOYSA-N
XLogP1.83
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol?
The IUPAC name of 1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol (CID 79069633) is 1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol.
What is the SMILES notation for 1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol?
The canonical SMILES for 1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol is CCC(C)(C(O)Cc1cnccc1N)N1CCCC1.
What is the InChIKey of 1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol?
The InChIKey is MEWVHGIEBDHGMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-3-15(2,18-8-4-5-9-18)14(19)10-12-11-17-7-6-13(12)16/h6-7,11,14,19H,3-5,8-10H2,1-2H3,(H2,16,17).
What are the key properties of 1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol?
1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol has a molecular weight of 263.38 g/mol, XLogP of 1.83, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-3-pyridinyl)-3-methyl-3-pyrrolidin-1-ylpentan-2-ol is sourced from PubChem (CID 79069633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).