(4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone

C14H22N4O — CID 81241912

IUPAC(4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone
SMILESCCN(CC)C1CCN(C(=O)c2cnccc2N)C1
InChIInChI=1S/C14H22N4O/c1-3-17(4-2)11-6-8-18(10-11)14(19)12-9-16-7-5-13(12)15/h5,7,9,11H,3-4,6,8,10H2,1-2H3,(H2,15,16)
InChIKeyIBEGMCWPUDBZRN-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.22
Rot. Bonds4

About (4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone

(4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone (PubChem CID 81241912) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is (4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name(4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone
PubChem CID81241912
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name(4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone
SMILESCCN(CC)C1CCN(C(=O)c2cnccc2N)C1
InChIInChI=1S/C14H22N4O/c1-3-17(4-2)11-6-8-18(10-11)14(19)12-9-16-7-5-13(12)15/h5,7,9,11H,3-4,6,8,10H2,1-2H3,(H2,15,16)
InChIKeyIBEGMCWPUDBZRN-UHFFFAOYSA-N
XLogP1.22
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3-(diethylamino)pyrrolidin-1-yl]-(3-fluoro-4-pyridinyl)methanone
CID 115661606
(2,4-diaminophenyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone
CID 63168429
(4-amino-3-pyridinyl)-(3-methylpiperidin-1-yl)methanone
CID 81236621
(3-amino-2-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone
CID 104742285
(2-amino-4,5-difluorophenyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone
CID 63168602
(2-amino-4-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone
CID 55158605
(4-amino-2-chlorophenyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone
CID 63167985
(6-aminopyridazin-3-yl)-[3-(diethylamino)pyrrolidin-1-yl]methanone
CID 55158606
(4-amino-3-pyridinyl)-(4-propylpiperazin-1-yl)methanone
CID 81236290
(4-amino-3-pyridinyl)-[4-(cyclopropylmethyl)piperazin-1-yl]methanone
CID 81239759
(4-chloro-3-pyridinyl)-[3-(dimethylamino)pyrrolidin-1-yl]methanone
CID 81226397
[(3R)-3-(diethylamino)pyrrolidin-1-yl]-(5-ethyl-1,2-oxazol-4-yl)methanone
CID 99946662

Frequently Asked Questions

What is the IUPAC name of (4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone?
The IUPAC name of (4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone (CID 81241912) is (4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone.
What is the SMILES notation for (4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone?
The canonical SMILES for (4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone is CCN(CC)C1CCN(C(=O)c2cnccc2N)C1.
What is the InChIKey of (4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone?
The InChIKey is IBEGMCWPUDBZRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-3-17(4-2)11-6-8-18(10-11)14(19)12-9-16-7-5-13(12)15/h5,7,9,11H,3-4,6,8,10H2,1-2H3,(H2,15,16).
What are the key properties of (4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone?
(4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone has a molecular weight of 262.36 g/mol, XLogP of 1.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-3-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone is sourced from PubChem (CID 81241912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).