N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine

C12H19N3O — CID 114400660

IUPACN-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine
SMILESCCN1CCOC(CNc2ccncc2)C1
InChIInChI=1S/C12H19N3O/c1-2-15-7-8-16-12(10-15)9-14-11-3-5-13-6-4-11/h3-6,12H,2,7-10H2,1H3,(H,13,14)
InChIKeyDPPPDJTZZWGANN-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.21
Rot. Bonds4

About N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine

N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine (PubChem CID 114400660) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine.

Molecular Properties

Compound NameN-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine
PubChem CID114400660
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine
SMILESCCN1CCOC(CNc2ccncc2)C1
InChIInChI=1S/C12H19N3O/c1-2-15-7-8-16-12(10-15)9-14-11-3-5-13-6-4-11/h3-6,12H,2,7-10H2,1H3,(H,13,14)
InChIKeyDPPPDJTZZWGANN-UHFFFAOYSA-N
XLogP1.21
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine?
The IUPAC name of N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine (CID 114400660) is N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine.
What is the SMILES notation for N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine?
The canonical SMILES for N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine is CCN1CCOC(CNc2ccncc2)C1.
What is the InChIKey of N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine?
The InChIKey is DPPPDJTZZWGANN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-2-15-7-8-16-12(10-15)9-14-11-3-5-13-6-4-11/h3-6,12H,2,7-10H2,1H3,(H,13,14).
What are the key properties of N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine?
N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine has a molecular weight of 221.30 g/mol, XLogP of 1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine is sourced from PubChem (CID 114400660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).