N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine

C20H26N4O — CID 75446101

IUPACN-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine
SMILESc1ccc(N2CCC(NCc3ccccc3N3CCOCC3)C2)nc1
InChIInChI=1S/C20H26N4O/c1-2-6-19(23-11-13-25-14-12-23)17(5-1)15-22-18-8-10-24(16-18)20-7-3-4-9-21-20/h1-7,9,18,22H,8,10-16H2
InChIKeyYZEQVOKTHMWWKA-UHFFFAOYSA-N
MW338.45 g/mol
LogP2.29
Rot. Bonds5

About N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine

N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine (PubChem CID 75446101) has the molecular formula C20H26N4O and a molecular weight of 338.45 g/mol. Its IUPAC name is N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine
PubChem CID75446101
Molecular FormulaC20H26N4O
Molecular Weight338.45 g/mol
Exact Mass338.21
IUPAC NameN-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine
SMILESc1ccc(N2CCC(NCc3ccccc3N3CCOCC3)C2)nc1
InChIInChI=1S/C20H26N4O/c1-2-6-19(23-11-13-25-14-12-23)17(5-1)15-22-18-8-10-24(16-18)20-7-3-4-9-21-20/h1-7,9,18,22H,8,10-16H2
InChIKeyYZEQVOKTHMWWKA-UHFFFAOYSA-N
XLogP2.29
TPSA40.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(3S)-3-[(2-morpholin-4-ylphenyl)methylamino]piperidin-1-yl]-1H-pyrazin-2-one
CID 129475293
4-[(2-morpholin-4-ylphenyl)methylamino]cyclohexan-1-ol
CID 110928598
N-[(2-aminophenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 66387456
N-methyl-1-pyridin-2-ylpyrrolidin-3-amine
CID 79002061
(3R)-N-methyl-1-pyridin-2-ylpyrrolidin-3-amine
CID 141191344
(3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine
CID 124623272
(3S)-1-pyridin-2-yl-N-[(5-thiophen-2-yl-1H-pyrazol-4-yl)methyl]pyrrolidin-3-amine
CID 97337761
N-(oxepan-4-yl)-1-pyridin-2-ylpiperidin-4-amine
CID 65082180
2-(5-morpholin-4-yltetrazol-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)acetamide
CID 90621314
N-(1-pyridin-2-ylpyrrolidin-3-yl)formamide
CID 134430978
N-(1-pyridin-2-ylpyrrolidin-3-yl)cyclopropanesulfonamide
CID 90621445
N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 119126767

Frequently Asked Questions

What is the IUPAC name of N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine?
The IUPAC name of N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine (CID 75446101) is N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine.
What is the SMILES notation for N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine?
The canonical SMILES for N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine is c1ccc(N2CCC(NCc3ccccc3N3CCOCC3)C2)nc1.
What is the InChIKey of N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine?
The InChIKey is YZEQVOKTHMWWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O/c1-2-6-19(23-11-13-25-14-12-23)17(5-1)15-22-18-8-10-24(16-18)20-7-3-4-9-21-20/h1-7,9,18,22H,8,10-16H2.
What are the key properties of N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine?
N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine has a molecular weight of 338.45 g/mol, XLogP of 2.29, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 75446101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).