N-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide

C18H29N3O2 — CID 71098344

IUPACN-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide
SMILESCCc1cc(CN2CCOCC2)cc(NC(=O)C(C)(C)CC)n1
InChIInChI=1S/C18H29N3O2/c1-5-15-11-14(13-21-7-9-23-10-8-21)12-16(19-15)20-17(22)18(3,4)6-2/h11-12H,5-10,13H2,1-4H3,(H,19,20,22)
InChIKeyNOTMZLVWWRRLTM-UHFFFAOYSA-N
MW319.45 g/mol
LogP2.85
Rot. Bonds6

About N-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide

N-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide (PubChem CID 71098344) has the molecular formula C18H29N3O2 and a molecular weight of 319.45 g/mol. Its IUPAC name is N-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide.

Molecular Properties

Compound NameN-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide
PubChem CID71098344
Molecular FormulaC18H29N3O2
Molecular Weight319.45 g/mol
Exact Mass319.23
IUPAC NameN-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide
SMILESCCc1cc(CN2CCOCC2)cc(NC(=O)C(C)(C)CC)n1
InChIInChI=1S/C18H29N3O2/c1-5-15-11-14(13-21-7-9-23-10-8-21)12-16(19-15)20-17(22)18(3,4)6-2/h11-12H,5-10,13H2,1-4H3,(H,19,20,22)
InChIKeyNOTMZLVWWRRLTM-UHFFFAOYSA-N
XLogP2.85
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.45
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-dimethyl-N-[4-(morpholin-4-ylmethyl)-5-propan-2-yl-2-pyridinyl]butanamide
CID 69164218
N-[2-fluoro-4-methyl-5-(morpholin-4-ylmethyl)phenyl]-2,2-dimethylbutanamide
CID 45484683
2,2-diethyl-N-[4-(morpholin-4-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]butanamide
CID 69167205
tert-butyl N-[6-(morpholin-4-ylmethyl)-2-pyridinyl]carbamate
CID 67025080
N-chloro-4-(morpholin-4-ylmethyl)pyridin-2-amine
CID 87380885
4-[(3,5-ditert-butylphenyl)methyl]morpholine
CID 59709271
4-[(2-tert-butyl-4-pyridinyl)methyl]morpholine
CID 58209224
4-(1,4-oxazepan-4-ylmethyl)-N-propylpyridin-2-amine
CID 55139785
2-amino-2-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide
CID 119830508
[4-(morpholin-4-ylmethyl)-2-pyridinyl]methanol
CID 18799862
(2S)-2-amino-N-[4-(morpholin-4-ylmethyl)phenyl]pentanamide
CID 107569254
N-ethyl-5-(morpholin-4-ylmethyl)pyridin-2-amine
CID 62177527

Frequently Asked Questions

What is the IUPAC name of N-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide?
The IUPAC name of N-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide (CID 71098344) is N-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide.
What is the SMILES notation for N-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide?
The canonical SMILES for N-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide is CCc1cc(CN2CCOCC2)cc(NC(=O)C(C)(C)CC)n1.
What is the InChIKey of N-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide?
The InChIKey is NOTMZLVWWRRLTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O2/c1-5-15-11-14(13-21-7-9-23-10-8-21)12-16(19-15)20-17(22)18(3,4)6-2/h11-12H,5-10,13H2,1-4H3,(H,19,20,22).
What are the key properties of N-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide?
N-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide has a molecular weight of 319.45 g/mol, XLogP of 2.85, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-ethyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]-2,2-dimethylbutanamide is sourced from PubChem (CID 71098344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).