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

C16H26N4O — CID 63170840

IUPACN-ethyl-3-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine
SMILESCCNc1ncccc1CN1CCC(N2CCOCC2)C1
InChIInChI=1S/C16H26N4O/c1-2-17-16-14(4-3-6-18-16)12-19-7-5-15(13-19)20-8-10-21-11-9-20/h3-4,6,15H,2,5,7-13H2,1H3,(H,17,18)
InChIKeyVRLQYUROMSILTM-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.42
Rot. Bonds5

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

N-ethyl-3-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine (PubChem CID 63170840) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-ethyl-3-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-3-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine
PubChem CID63170840
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-ethyl-3-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine
SMILESCCNc1ncccc1CN1CCC(N2CCOCC2)C1
InChIInChI=1S/C16H26N4O/c1-2-17-16-14(4-3-6-18-16)12-19-7-5-15(13-19)20-8-10-21-11-9-20/h3-4,6,15H,2,5,7-13H2,1H3,(H,17,18)
InChIKeyVRLQYUROMSILTM-UHFFFAOYSA-N
XLogP1.42
TPSA40.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-3-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine
CID 63165530
3-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylmethyl)-N-ethylpyridin-2-amine
CID 62471001
3-[(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)methyl]-N-propylpyridin-2-amine
CID 79164091
N-ethyl-6-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine
CID 79232023
3-[(2,2-dimethylmorpholin-4-yl)methyl]-N-ethylpyridin-2-amine
CID 62470276
4-[1-[(2-bromophenyl)methyl]pyrrolidin-3-yl]morpholine
CID 63170781
1-[[2-(ethylamino)-3-pyridinyl]methyl]piperidine-4-carboxamide
CID 55075402
3-[(3-methylpyrrolidin-1-yl)methyl]-N-propylpyridin-2-amine
CID 55075699
N-ethyl-3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridin-2-amine
CID 55075566
[3-[(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)methyl]-2-pyridinyl]hydrazine
CID 79175108
3-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine-2-carbonitrile
CID 63169618
3-[(4-methylpiperidin-1-yl)methyl]-N-propylpyridin-2-amine
CID 62470200

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine?
The IUPAC name of N-ethyl-3-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine (CID 63170840) is N-ethyl-3-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine.
What is the SMILES notation for N-ethyl-3-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine?
The canonical SMILES for N-ethyl-3-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine is CCNc1ncccc1CN1CCC(N2CCOCC2)C1.
What is the InChIKey of N-ethyl-3-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine?
The InChIKey is VRLQYUROMSILTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-2-17-16-14(4-3-6-18-16)12-19-7-5-15(13-19)20-8-10-21-11-9-20/h3-4,6,15H,2,5,7-13H2,1H3,(H,17,18).
What are the key properties of N-ethyl-3-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine?
N-ethyl-3-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine has a molecular weight of 290.41 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 63170840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).