N,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine

C18H24N4O — CID 110113468

IUPACN,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine
SMILESCNc1cc(C)nc(C2CN(Cc3ccc(C)nc3)CCO2)c1
InChIInChI=1S/C18H24N4O/c1-13-4-5-15(10-20-13)11-22-6-7-23-18(12-22)17-9-16(19-3)8-14(2)21-17/h4-5,8-10,18H,6-7,11-12H2,1-3H3,(H,19,21)
InChIKeyBGQUIKYHBHYNLS-UHFFFAOYSA-N
MW312.42 g/mol
LogP2.71
Rot. Bonds4

About N,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine

N,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine (PubChem CID 110113468) has the molecular formula C18H24N4O and a molecular weight of 312.42 g/mol. Its IUPAC name is N,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine.

Molecular Properties

Compound NameN,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine
PubChem CID110113468
Molecular FormulaC18H24N4O
Molecular Weight312.42 g/mol
Exact Mass312.20
IUPAC NameN,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine
SMILESCNc1cc(C)nc(C2CN(Cc3ccc(C)nc3)CCO2)c1
InChIInChI=1S/C18H24N4O/c1-13-4-5-15(10-20-13)11-22-6-7-23-18(12-22)17-9-16(19-3)8-14(2)21-17/h4-5,8-10,18H,6-7,11-12H2,1-3H3,(H,19,21)
InChIKeyBGQUIKYHBHYNLS-UHFFFAOYSA-N
XLogP2.71
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine?
The IUPAC name of N,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine (CID 110113468) is N,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine.
What is the SMILES notation for N,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine?
The canonical SMILES for N,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine is CNc1cc(C)nc(C2CN(Cc3ccc(C)nc3)CCO2)c1.
What is the InChIKey of N,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine?
The InChIKey is BGQUIKYHBHYNLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O/c1-13-4-5-15(10-20-13)11-22-6-7-23-18(12-22)17-9-16(19-3)8-14(2)21-17/h4-5,8-10,18H,6-7,11-12H2,1-3H3,(H,19,21).
What are the key properties of N,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine?
N,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine has a molecular weight of 312.42 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-6-[4-[(6-methyl-3-pyridinyl)methyl]morpholin-2-yl]pyridin-4-amine is sourced from PubChem (CID 110113468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).