N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide

C14H22N4O2 — CID 110253457

IUPACN,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide
SMILESCNC(=O)C1(C)CN(Cc2cccnc2NC)CCO1
InChIInChI=1S/C14H22N4O2/c1-14(13(19)16-3)10-18(7-8-20-14)9-11-5-4-6-17-12(11)15-2/h4-6H,7-10H2,1-3H3,(H,15,17)(H,16,19)
InChIKeyLKDVGNSXTCKHFW-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.46
Rot. Bonds4

About N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide

N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide (PubChem CID 110253457) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide
PubChem CID110253457
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC NameN,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide
SMILESCNC(=O)C1(C)CN(Cc2cccnc2NC)CCO1
InChIInChI=1S/C14H22N4O2/c1-14(13(19)16-3)10-18(7-8-20-14)9-11-5-4-6-17-12(11)15-2/h4-6H,7-10H2,1-3H3,(H,15,17)(H,16,19)
InChIKeyLKDVGNSXTCKHFW-UHFFFAOYSA-N
XLogP0.46
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide?
The IUPAC name of N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide (CID 110253457) is N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide.
What is the SMILES notation for N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide?
The canonical SMILES for N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide is CNC(=O)C1(C)CN(Cc2cccnc2NC)CCO1.
What is the InChIKey of N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide?
The InChIKey is LKDVGNSXTCKHFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-14(13(19)16-3)10-18(7-8-20-14)9-11-5-4-6-17-12(11)15-2/h4-6H,7-10H2,1-3H3,(H,15,17)(H,16,19).
What are the key properties of N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide?
N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 0.46, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide is sourced from PubChem (CID 110253457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).