N-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine

C14H22ClN3O — CID 62293153

IUPACN-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine
SMILESCCNCc1nc(N2CCOCC2(C)C)ccc1Cl
InChIInChI=1S/C14H22ClN3O/c1-4-16-9-12-11(15)5-6-13(17-12)18-7-8-19-10-14(18,2)3/h5-6,16H,4,7-10H2,1-3H3
InChIKeyNTWRXFCJAXMGKS-UHFFFAOYSA-N
MW283.80 g/mol
LogP2.46
Rot. Bonds4

About N-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine

N-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine (PubChem CID 62293153) has the molecular formula C14H22ClN3O and a molecular weight of 283.80 g/mol. Its IUPAC name is N-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine
PubChem CID62293153
Molecular FormulaC14H22ClN3O
Molecular Weight283.80 g/mol
Exact Mass283.15
IUPAC NameN-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine
SMILESCCNCc1nc(N2CCOCC2(C)C)ccc1Cl
InChIInChI=1S/C14H22ClN3O/c1-4-16-9-12-11(15)5-6-13(17-12)18-7-8-19-10-14(18,2)3/h5-6,16H,4,7-10H2,1-3H3
InChIKeyNTWRXFCJAXMGKS-UHFFFAOYSA-N
XLogP2.46
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.80
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine with MolForge

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Related Compounds

N-[[5-chloro-2-(3,3-dimethylmorpholin-4-yl)-4-pyridinyl]methyl]ethanamine
CID 114926070
N-[[2-(3,3-dimethylmorpholin-4-yl)-1,3-oxazol-4-yl]methyl]ethanamine
CID 113377733
N-[(3-chloro-6-morpholin-4-yl-2-pyridinyl)methyl]-2-methylpropan-1-amine
CID 62285577
N-[[3-chloro-6-(4-methylsulfonylpiperazin-1-yl)-2-pyridinyl]methyl]ethanamine
CID 63004009
4-[6-(chloromethyl)-2-pyridinyl]-3,3-dimethylmorpholine
CID 62254126
1-[6-(3,3-dimethylmorpholin-4-yl)pyridazin-3-yl]-N-methylmethanamine
CID 62287376
N-[[3-chloro-6-(3-methoxypyrrolidin-1-yl)-2-pyridinyl]methyl]ethanamine
CID 103539397
N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine
CID 83061614
N-[[3-chloro-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-2-pyridinyl]methyl]ethanamine
CID 79164517
N-[[3-chloro-6-(3,3,4-trimethylpiperazin-1-yl)-2-pyridinyl]methyl]propan-1-amine
CID 63619428
N-[[6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62293152
N-[[3-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-pyridinyl]methyl]ethanamine
CID 63026350

Frequently Asked Questions

What is the IUPAC name of N-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine (CID 62293153) is N-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine is CCNCc1nc(N2CCOCC2(C)C)ccc1Cl.
What is the InChIKey of N-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine?
The InChIKey is NTWRXFCJAXMGKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22ClN3O/c1-4-16-9-12-11(15)5-6-13(17-12)18-7-8-19-10-14(18,2)3/h5-6,16H,4,7-10H2,1-3H3.
What are the key properties of N-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine?
N-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine has a molecular weight of 283.80 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-chloro-6-(3,3-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 62293153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).